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Spectrum Details
HMDB ID:HMDB0000023
Compound name:(S)-3-Hydroxyisobutyric acid
Spectrum type:[1H, 13C]-HSQC NMR Spectrum (2D, 600 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
Spectrum View
Experimental Conditions
Sample Concentration:50.0 mM
Solvent:Water
Sample Mass:5.2 mg
Sample Assessment:Excellent
Spectrum Assessment:Excellent
Instrument Type:Bruker
Nucleus X:1H
Nucleus Y:13C
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 file300 Bytes
Peak Assignments (PNG)Download file39.1 KB
Spectra Image with Peak Assignments (PNG)Download file39.1 KB
Raw Spectrum Image (PNG)Download file6.61 KB
nmrML FileNot AvailableNot Available
JCAMP-DX FileNot AvailableNot Available
Raw Free Induction Decay (FID) File for Spectral Processing (Bruker) (ZIP)Download file1.5 MB
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 ]
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