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Hexadecyl pentanoate
SpectraBase Compound ID F564EpW9ZY6
InChI InChI=1S/C21H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-23-21(22)19-6-4-2/h3-20H2,1-2H3
InChIKey OSIFZWLCMRYWEE-UHFFFAOYSA-N
Mol Weight 326.6 g/mol
Molecular Formula C21H42O2
Exact Mass 326.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TNPnLAXbYP
Name Hexadecyl pentanoate
Alternate Name(s) Valeric acid, hexadecyl ester Pentanoic acid hexadecyl ester
CAS Registry Number 125164-54-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H42O2
InChI InChI=1S/C21H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-23-21(22)19-6-4-2/h3-20H2,1-2H3
InChIKey OSIFZWLCMRYWEE-UHFFFAOYSA-N
Molecular Weight 326.565 g/mol
SMILES CCCCC(=O)OCCCCCCCCCCCCCCCC
SPLASH splash10-0a4l-9100000000-17576bf6478c6d613137
Source of Spectrum NP-11-5548-0
Wiley ID 1109694