Hmdb loader
Spectrum Details
HMDB ID:HMDB0000958
Compound name:trans-Aconitic acid
Spectrum type:1H NMR Spectrum (1D, 500 MHz, H2O, experimental)
Disclaimer:While we have made our best-effort to label most spectral peaks, certain spectral features may not be fully annotated in all NMR spectra
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Experimental Conditions
Solvent:Water
Sample Mass:5.0 mg
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Varian
Nucleus:1H
Frequency:500 MHz
Sample pH:3.50
Sample Temperature:25.0 Celsius
Chemical Shift Reference:DSS
Documentation
Document DescriptionDownloadFile Size
List of chemical shift values for the spectrum (TXT)Download file333 Bytes
Peak Assignments (PNG)Download file92.6 KB
Spectra Image with Peak Assignments (PNG)Download file92.6 KB
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file1.34 MB
JCAMP-DX File (JDX)Download file74.6 KB
Raw Free Induction Decay (FID) File for Spectral Processing (Varian) (ZIP)Download file85.9 KB
Validation Report (TAR)Download file20 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 ]
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