Np mrd loader

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Spectrum Details
NP-MRD ID:NP0000009
Compound name:Caffeine
Spectrum type:1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental)
Spectrum View
Spectra Viewer Instructions...

Experimental Conditions
Sample Concentration:50.0 mM
Solvent:CDCl3
Sample Mass:6.4 mg
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Varian
Nucleus:1H
Frequency:500 MHz
Sample pH:Not Applic
Sample Temperature:25.0 Celsius
Chemical Shift Reference:CHCl3
Documentation
Document DescriptionDownloadFile Size
List of chemical shift values for the spectrum (TXT)Download file495 Bytes
Peak Assignments (PNG)Download file102 KB
Spectra Image with Peak Assignments (PNG)Download file102 KB
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file811 KB
JCAMP-DX File (JDX)Download file778 KB
Raw Free Induction Decay (FID) File for Spectral Processing (Varian) (ZIP)Download file92.9 KB
Validation ReportNot AvailableNot Available
References
  1. Wishart DS, Knox C, Guo AC, Eisner R, Young N, Gautam B, Hau DD, Psychogios N, Dong E, Bouatra S, Mandal R, Sinelnikov I, Xia J, Jia L, Cruz JA, Lim E, Sobsey CA, Shrivastava S, Huang P, Liu P, Fang L, Peng J, Fradette R, Cheng D, Tzur D, Clements M, Lewis A, De Souza A, Zuniga A, Dawe M, Xiong Y, Clive D, Greiner R, Nazyrova A, Shaykhutdinov R, Li L, Vogel HJ, Forsythe I: HMDB: a knowledgebase for the human metabolome. Nucleic Acids Res. 2009 Jan;37(Database issue):D603-10. doi: 10.1093/nar/gkn810. Epub 2008 Oct 25. [PubMed: 18953024 ]