For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoicacid,pentyl ester
SpectraBase Compound ID Lh2k4kuaZjM
InChI InChI=1S/C12H16O2/c1-2-3-7-10-14-12(13)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3
InChIKey QKNZNUNCDJZTCH-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1LutSyLjjMy
Name Benzoic acid, pentyl ester
CAS Registry Number 2049-96-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-2-3-7-10-14-12(13)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3
InChIKey QKNZNUNCDJZTCH-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES CCCCCOC(c1ccccc1)=O
SPLASH splash10-0adi-9400000000-c510e15a8e2b5e32e52e
Source of Spectrum AA-0-1338-2
Synonyms Amyl benzoate benzoic acid amyl ester n-Amyl benzoate n-Pentyl benzoate Pentyl benzoate AI3-07998 BRN 2046708 EINECS 218-077-6
Wiley ID 21199