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Hexanoic acid pentyl ester
SpectraBase Compound ID GQcKFT1ZQf3
InChI InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3
InChIKey WRFZKAGPPQGDDQ-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzWUIt1Uvo3
Name Hexanoic acid, pentyl ester
Alternate Name(s) Amyl caproate Amyl capronate Amyl hexanoate Amyl hexoate Hexanoic acid amyl ester n-Amyl caproate n-Amyl n-hexanoate Pentyl caproate Pentyl hexanoate AI3-06030 BRN 1760251 EINECS 208-732-4 FEMA NO. 2074 NSC 46119
CAS Registry Number 540-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3
InChIKey WRFZKAGPPQGDDQ-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES CCCCCOC(=O)CCCCC
SPLASH splash10-006x-9100000000-0f2b95ae64274dc43e89
Source of Spectrum W5-13288-0-0
Wiley ID 1183093