Spectrum Details
FooDB ID:FDB000457
Compound name:xi-1-(3,4-Dihydroxyphenyl)-1,2-ethanediol
Spectrum type:1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
Spectrum View
Spectra Viewer Instructions...

Experimental Conditions
Sample Concentration:2.0 mM
Solvent:Water
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Varian
Nucleus:1H
Frequency:500 MHz
Sample pH:7.00
Sample Temperature:25.0 Celsius
Chemical Shift Reference:DSS
Documentation
Document DescriptionDownloadFile Size
List of chemical shift values for the spectrum (TXT)Download file525 Bytes
Peak Assignments (PNG)Download file108 KB
Spectra Image with Peak Assignments (PNG)Download file108 KB
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file1.34 MB
JCAMP-DX File (JDX)Download file100 KB
Raw Free Induction Decay (FID) File for Spectral Processing (Varian) (ZIP)Download file180 KB
Validation Report (TAR)Download file20.5 KB
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 ]