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7-Octynoic acid, methyl ester
SpectraBase Compound ID 1Pcx2y3c3Se
InChI InChI=1S/C9H14O2/c1-3-4-5-6-7-8-9(10)11-2/h1H,4-8H2,2H3
InChIKey ZOSMTPMVTGVSDE-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmU5k5DGTio
Name 7-Octynoic acid, methyl ester
CAS Registry Number 18458-50-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-3-4-5-6-7-8-9(10)11-2/h1H,4-8H2,2H3
InChIKey ZOSMTPMVTGVSDE-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES C(CCCCC#C)C(OC)=O
SPLASH splash10-0acc-9000000000-bd2024d7931f9f57a0d8
Source of Spectrum EP-4859-0-0
Synonyms Methyl 7-octynoate Methyl oct-7-ynoate Oct-7-ynoic acid methyl ester
Wiley ID 1151132