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

*Links on SpectraBase are not permalinks.
Benzoic acid, 4-fluoro-, difluoromethyl ester
SpectraBase Compound ID 3IUUrfKFE79
InChI InChI=1S/C8H5F3O2/c9-6-3-1-5(2-4-6)7(12)13-8(10)11/h1-4,8H
InChIKey BGCNLJSPWWLVOW-UHFFFAOYSA-N
Mol Weight 190.12 g/mol
Molecular Formula C8H5F3O2
Exact Mass 190.024164 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 HSStmyIfiNg
Name Benzoic acid, 4-fluoro-, difluoromethyl ester
Alternate Name(s) difluoromethyl 4-fluorobenzoate
CAS Registry Number 120608-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5F3O2
InChI InChI=1S/C8H5F3O2/c9-6-3-1-5(2-4-6)7(12)13-8(10)11/h1-4,8H
InChIKey BGCNLJSPWWLVOW-UHFFFAOYSA-N
Molecular Weight 190.121 g/mol
SMILES C(OC(F)F)(c1ccc(cc1)F)=O
SPLASH splash10-00di-4900000000-d149f205eb8170617051
Source of Spectrum J-54-3026-5
Wiley ID 1186120