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

*Links on SpectraBase are not permalinks.
Benzoic acid, pentamethyl-
SpectraBase Compound ID AJbxDxlGNyj
InChI InChI=1S/C12H16O2/c1-6-7(2)9(4)11(12(13)14)10(5)8(6)3/h1-5H3,(H,13,14)
InChIKey MNLKGWIYXCKWBU-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 DqI0krGCUSp
Name Benzoic acid, pentamethyl-
CAS Registry Number 2243-32-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-6-7(2)9(4)11(12(13)14)10(5)8(6)3/h1-5H3,(H,13,14)
InChIKey MNLKGWIYXCKWBU-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES OC(=O)c1c(C)c(C)c(C)c(c1C)C
SPLASH splash10-0007-0900000000-d493c093d13a100bf9d7
Source of Spectrum J-62-8797-9
Synonyms 2,3,4,5,6-Pentamethylbenzoic acid Pentamethylbenzoic acid EINECS 218-809-4
Wiley ID 1188791