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3-Octenoic acid, 7-hydroxy-, methyl ester, (.+-.)-
SpectraBase Compound ID 4GA2xtLTwKc
InChI InChI=1S/C9H16O3/c1-8(10)6-4-3-5-7-9(11)12-2/h3,5,8,10H,4,6-7H2,1-2H3/b5-3+
InChIKey FGOAFXMRVCIGJX-HWKANZROSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OLu2T7LZOo
Name 3-Octenoic acid, 7-hydroxy-, methyl ester, (.+-.)-
CAS Registry Number 83060-30-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-8(10)6-4-3-5-7-9(11)12-2/h3,5,8,10H,4,6-7H2,1-2H3/b5-3+
InChIKey FGOAFXMRVCIGJX-HWKANZROSA-N
Molecular Weight 172.224 g/mol
SMILES OC(CC\C=C\CC(=O)OC)C
SPLASH splash10-0005-9300000000-36f2cde34b282d8834cf
Source of Spectrum H-65-448-0
Synonyms Methyl (3E)-7-hydroxy-3-octenoate Methyl ester of (+,-)-7-hydroxy-3-octenoic acid
Wiley ID 1168661