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Heptanoic acid, pentyl ester
SpectraBase Compound ID 9YIEkvbjnCP
InChI InChI=1S/C12H24O2/c1-3-5-7-8-10-12(13)14-11-9-6-4-2/h3-11H2,1-2H3
InChIKey PSQMUBJRXIGVIT-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NAgYwDj8bK
Name Amyl heptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-3-5-7-8-10-12(13)14-11-9-6-4-2/h3-11H2,1-2H3
InChIKey PSQMUBJRXIGVIT-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 200.322 g/mol
SMILES CCCCCCC(=O)OCCCCC
SPLASH splash10-006x-9200000000-c427b25d7c4b53e55413
Source of Spectrum SRH-2022-6423-0
Synonyms Pentyl heptanoate
Wiley ID 1828253