Np mrd loader

Filter by kingdom:
Filter by solvent:
Filter by spectral type:
Filter by nucleus:
Filter by spectra quality:
Filter by assignment quality:
Displaying natural products 12701 - 12725 of 291183 in total
NP-MRD ID
CAS Number
Compound Name Species of OriginChemical StructureChemical Formula
Average Mass
Monoisotopic Mass
NMR Spectra
3-amino-2-hydroxy-n-(2-methanesulfinylethyl)propanimidic acid
  • Smilax china
ThumbC6H14N2O3S

194.2500 Da
194.07251 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
(2r)-3-amino-2-hydroxy-n-{2-[(s)-methanesulfinyl]ethyl}propanimidic acid
  • Smilax china
ThumbC6H14N2O3S

194.2500 Da
194.07251 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
1-[3-methoxy-5-(prop-1-yn-1-yl)thiophen-2-yl]ethanone
  • Artemisia absinthium
ThumbC10H10O2S

194.2500 Da
194.04015 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
3-[(prop-2-en-1-yloxysulfonyl)sulfanyl]prop-1-ene
  • Allium ursinum
ThumbC6H10O3S2

194.2600 Da
194.00714 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
(2r)-3-(acetylsulfanyl)-2-(sulfanylmethyl)propanoic acid
  • Asparagus officinalis
ThumbC6H10O3S2

194.2600 Da
194.00714 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
7,8-dithia-3,12-diazatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),4,10-tetraene
  • Allium giganteum
ThumbC8H6N2S2

194.2700 Da
193.99724 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
cis-Carvyl acetate
  • Apium graveolens
  • Apium graveolens var. dulce
  • Aspergillus candidus
  • Citrus maxima
  • Mentha aquatica
  • Mentha spicata
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
cis-p-Mentha-1(7),8-dien-2-yl acetate
  • Apium graveolens
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Cnidilide
  • Apium graveolens
  • Apium graveolens var. dulce
  • Cnidium officinale
  • Levisticum officinale
  • Ligusticum chuanxiong
  • Peucedanum ostruthium
  • Scutellaria baicalensis
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
trans-Carvyl acetate
  • Apium graveolens
  • Apium graveolens var. dulce
  • Mentha spicata
  • Tanacetum vulgare
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Sabinyl acetate
  • Anthriscus sylvestris
  • Chrysanthemum indicum
  • Chrysanthemum oreastrum
  • Salvia officinalis
  • Salvia rosmarinus
  • Stoebe vulgaris
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Neocnidilide
  • Anethum graveolens
  • Angelica sinensis
  • Apium graveolens
  • Apium graveolens var. dulce
  • Apium graveolens var. rapaceum
  • Asarum canadense
  • Cnidium officinale
  • Coriandrum sativum L.
  • Levisticum officinale
  • Ligusticum chuanxiong
  • Ligusticum sinense
  • Petroselinum crispum
  • Scutellaria baicalensis
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
(-)-Myrtenyl acetate
  • Agathosma betulina
  • Ajania fruticulosa
  • Artemisia herba-alba
  • Chrysanthemum indicum
  • Curcuma mangga
  • Hyssopus officinalis L.
  • Juniperus communis
  • Mentha spicata
  • Myrtus communis
  • Satureja subspicata
  • Teucrium polium
  • Valeriana officinalis
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Ethyl (2E,4Z,7Z)-Decatrienoate
  • Pyrus pyrifolia
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
(±)-p-Mentha-1,8-dien-10-yl acetate
  • Citrus limon
  • Mentha aquatica
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Perillyl acetate
  • Citrus iyo
  • Citrus reticulata
  • Helianthus annuus
  • Helianthus annuus L.
  • Leonurus japonicus
  • Salvia dorisiana
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
Carvyl acetate
  • Agathosma betulina
  • Apium graveolens
  • Apium graveolens var. dulce
  • Carum carvi
  • Citrus X sinensis (L.) Osbeck (pro. sp.)
  • Citrus aurantiifolia
  • Citrus aurantium
  • Citrus hystrix
  • Citrus limon
  • Citrus maxima
  • Citrus paradisi
  • Citrus reticulata
  • Mentha aquatica
  • Mentha pulegium
  • Mentha x piperita
  • Santolina chamaecyparissus
  • (show allshow less)
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
3-ethenyl-5-methyl-2-methylidenehex-4-en-1-yl acetate
  • Artemisia vulgaris
ThumbC12H18O2

194.2701 Da
194.13068 Da
13C NMR Spectrum (1D, 25 MHz, H2O, predicted)
1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
13C NMR Spectrum (1D, 252 MHz, H2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, H2O, predicted)
13C NMR Spectrum (1D, 50 MHz, H2O, predicted)
1H NMR Spectrum (1D, 200 MHz, H2O, predicted)
13C NMR Spectrum (1D, 75 MHz, H2O, predicted)
1H NMR Spectrum (1D, 300 MHz, H2O, predicted)
13C NMR Spectrum (1D, 101 MHz, H2O, predicted)
1H NMR Spectrum (1D, 400 MHz, H2O, predicted)
13C NMR Spectrum (1D, 126 MHz, H2O, predicted)
1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
13C NMR Spectrum (1D, 151 MHz, H2O, predicted)
1H NMR Spectrum (1D, 600 MHz, H2O, predicted)
13C NMR Spectrum (1D, 176 MHz, H2O, predicted)
1H NMR Spectrum (1D, 700 MHz, H2O, predicted)
13C NMR Spectrum (1D, 201 MHz, H2O, predicted)
1H NMR Spectrum (1D, 800 MHz, H2O, predicted)
13C NMR Spectrum (1D, 226 MHz, H2O, predicted)
1H NMR Spectrum (1D, 900 MHz, H2O, predicted)
Ethyl (2E,4E,7Z)-Decatrienoate
  • Not Available
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
8-Ocimenyl acetate
  • Not Available
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
1-(2-Furanyl)-1-octanone
  • Not Available
ThumbC12H18O2

194.2701 Da
194.13068 Da
Not Available
S-Acetyl dihydroasparagusic acid
  • Asparagus officinalis
ThumbC6H10O3S2

194.2720 Da
194.00714 Da
Not Available
Elijopyrone C
  • Actinomyces sp.
ThumbC12H18O2

194.2740 Da
194.13068 Da
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
2-hydroxymethyl-3-pentylphenol
  • Xylaria nigripes
ThumbC12H18O2

194.2740 Da
194.13068 Da
13C NMR Spectrum (1D, 25 MHz, D2O, predicted)
1H NMR Spectrum (1D, 100 MHz, D2O, predicted)
13C NMR Spectrum (1D, 252 MHz, D2O, predicted)
1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)
13C NMR Spectrum (1D, 50 MHz, D2O, predicted)
1H NMR Spectrum (1D, 200 MHz, D2O, predicted)
13C NMR Spectrum (1D, 75 MHz, D2O, predicted)
1H NMR Spectrum (1D, 300 MHz, D2O, predicted)
13C NMR Spectrum (1D, 101 MHz, D2O, predicted)
1H NMR Spectrum (1D, 400 MHz, D2O, predicted)
13C NMR Spectrum (1D, 126 MHz, D2O, predicted)
1H NMR Spectrum (1D, 500 MHz, D2O, predicted)
13C NMR Spectrum (1D, 151 MHz, D2O, predicted)
1H NMR Spectrum (1D, 600 MHz, D2O, predicted)
13C NMR Spectrum (1D, 176 MHz, D2O, predicted)
1H NMR Spectrum (1D, 700 MHz, D2O, predicted)
13C NMR Spectrum (1D, 201 MHz, D2O, predicted)
1H NMR Spectrum (1D, 800 MHz, D2O, predicted)
13C NMR Spectrum (1D, 226 MHz, D2O, predicted)
1H NMR Spectrum (1D, 900 MHz, D2O, predicted)
7,7-dimethyl-2-methylenebicyclo[3.1.1]-heptan-6-ol acetate
  • Psiadia anchusifolia
ThumbC12H18O2

194.2740 Da
194.13068 Da
13C NMR Spectrum (1D, 500 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 500 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 100 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 100 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 200 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 200 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 300 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 300 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 400 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 600 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 600 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 700 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 700 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 800 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 800 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 900 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 900 MHz, CDCl3, simulated)
13C NMR Spectrum (1D, 1000 MHz, CDCl3, simulated)
1H NMR Spectrum (1D, 1000 MHz, CDCl3, simulated)
Displaying natural products 12701 - 12725 of 291183 in total