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(E)-7-methyl-5-octenoic acid methyl ester
SpectraBase Compound ID DLA4T3r5Uk6
InChI InChI=1S/C10H18O2/c1-9(2)7-5-4-6-8-10(11)12-3/h5,7,9H,4,6,8H2,1-3H3/b7-5+
InChIKey LQWSFKTUPQOUHH-FNORWQNLSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FO17rGLtbVK
Name (E)-7-methyl-5-octenoic acid methyl ester
CAS Registry Number 112375-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-9(2)7-5-4-6-8-10(11)12-3/h5,7,9H,4,6,8H2,1-3H3/b7-5+
InChIKey LQWSFKTUPQOUHH-FNORWQNLSA-N
Molecular Weight 170.252 g/mol
SMILES C(=O)(OC)CCC\C=C\C(C)C
SPLASH splash10-00di-9200000000-790fb714bf4009476a50
Source of Spectrum J-53-1069-0
Synonyms (E)-7-methyloct-5-enoic acid methyl ester Methyl (E)-7-methyloct-5-enoate
Wiley ID 1167180