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3-Hydroxybutanoic acid
SpectraBase Compound ID K2jk7GSyBjJ
InChI InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
InChIKey WHBMMWSBFZVSSR-UHFFFAOYSA-N
Mol Weight 104.1 g/mol
Molecular Formula C4H8O3
Exact Mass 104.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwIl0QZtIH5
Name Butanoic acid, 3-hydroxy-
Alternate Name(s) (1)-3-Hydroxybutyric acid beta-Hydroxybutyric acid .beta.-Hydroxy-n-butyric acid 3-Hydroxybutanoic acid .beta.-Hydroxybutyric acid 3 HBA 3-Hydroxybuttersaeure 3-Hydroxybutyric acid 3-Oxidanylbutanoic acid Butyric acid, 3-hydroxy- DL-.beta.-Hydroxybutyric acid (.+/-.)-3-Hydroxybutyric acid AI3-21675 EINECS 206-099-9 EINECS 210-908-0 NSC 3806
CAS Registry Number 300-85-6
Comments Less than 3 mono-isotopic peaks
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Formula C4H8O3
InChI InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
InChIKey WHBMMWSBFZVSSR-UHFFFAOYSA-N
Molecular Weight 104.105 g/mol
SMILES OC(CC(=O)O)C
SPLASH splash10-0006-9000000000-fcce8f664b67c0b8bb52
Source of Spectrum JX-2015-6-1351
Wiley ID 1728022