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Hexanoic acid, 5-methyl-, methyl ester
SpectraBase Compound ID OTMhLSKrsf
InChI InChI=1S/C8H16O2/c1-7(2)5-4-6-8(9)10-3/h7H,4-6H2,1-3H3
InChIKey VMHVFMBDCWCBHO-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53vD22cJcli
Name Hexanoic acid, 5-methyl-, methyl ester
CAS Registry Number 2177-83-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-7(2)5-4-6-8(9)10-3/h7H,4-6H2,1-3H3
InChIKey VMHVFMBDCWCBHO-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES CC(C)CCCC(=O)OC
SPLASH splash10-00dl-9000000000-8de418859357c522d205
Source of Spectrum HE-1986-1413-0
Synonyms 5-Methylhexanoic acid methyl ester Methyl 5-methylcaproate Methyl 5-methylhexanoate
Wiley ID 1142629