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Isovaleric acid
SpectraBase Compound ID 5glfD3OBiMq
InChI InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)
InChIKey GWYFCOCPABKNJV-UHFFFAOYSA-N
Mol Weight 102.13 g/mol
Molecular Formula C5H10O2
Exact Mass 102.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tAteebdPJk
Name 3-Methylbutanoic acid
CAS Registry Number 503-74-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H10O2
InChI InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)
InChIKey GWYFCOCPABKNJV-UHFFFAOYSA-N
Molecular Weight 102.133 g/mol
SMILES OC(CC(C)C)=O
SPLASH splash10-03dl-9000000000-e3f2451273d4280780b9
Source of Spectrum MG-228-0-0
Synonyms Butanoic acid, 3-methyl- Isovaleric acid 3-Methyl-butanoic acid iso-valeric acid 3-Methyl-n-butyric acid 3-Methylbutyrate 3-Methylbutyric acid Acetic acid, isopropyl- Butyric acid, 3-methyl- Delphinic acid iso-C4H9COOH Isobutyl formic acid Isopropylacetic acid Isovalerianic Isovalerianic acid Isovaleric acid sodium salt Kyselina isovalerova Methyl butanoic acid AI3-24132 BRN 1098522 EINECS 207-975-3 HSDB 629 NSC 62783
Wiley ID 1120281