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Spectrum Details
HMDB ID:HMDB0000749
Compound name:Mesaconic acid
Spectrum type:1H NMR Spectrum (1D, 600 MHz, H2O, experimental)
Spectrum View
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Experimental Conditions
Sample Concentration:23.0 mM
Solvent:Water
Sample Mass:3.0 mg
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Bruker
Nucleus:1H
Frequency:600 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 file356 Bytes
Peak Assignments (PNG)Download file87.8 KB
Spectra Image with Peak Assignments (PNG)Download file87.8 KB
Raw Spectrum Image (PNG)Download file7.83 KB
nmrML FileNot AvailableNot Available
JCAMP-DX File (JDX)Download file886 KB
Raw Free Induction Decay (FID) File for Spectral Processing (Bruker) (ZIP)Download file149 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 ]