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Methyl 2-hydroxyheptanoate
SpectraBase Compound ID FqRlemTgpoG
InChI InChI=1S/C8H16O3/c1-3-4-5-6-7(9)8(10)11-2/h7,9H,3-6H2,1-2H3
InChIKey ZKBFAXBOTWDLBL-UHFFFAOYSA-N
Mol Weight 160.21 g/mol
Molecular Formula C8H16O3
Exact Mass 160.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JCjh3ulDg4c
Name Heptanoic acid, 2-hydroxy-, methyl ester
CAS Registry Number 54340-91-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O3
InChI InChI=1S/C8H16O3/c1-3-4-5-6-7(9)8(10)11-2/h7,9H,3-6H2,1-2H3
InChIKey ZKBFAXBOTWDLBL-UHFFFAOYSA-N
Molecular Weight 160.213 g/mol
SMILES OC(CCCCC)C(OC)=O
SPLASH splash10-002f-9000000000-64a42db5d9e50e4ff5d1
Source of Spectrum T-67-1151-0
Synonyms 2-Hydroxyenanthic acid methyl ester 2-Hydroxyheptanoic acid methyl ester Methyl 2-hydroxyheptanoate Methyl 2-oxidanylheptanoate
Wiley ID 12678