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

*Links on SpectraBase are not permalinks.
Ethyl 2-deuterio-4-(4'-methoxyphenyl)-2-(trifluoromethyl)-4-oxobutanoate
SpectraBase Compound ID 1mXjkCCpI4M
InChI InChI=1S/C14H15F3O4/c1-3-21-13(19)11(14(15,16)17)8-12(18)9-4-6-10(20-2)7-5-9/h4-7,11H,3,8H2,1-2H3/i11D
InChIKey FUUABHWGJHJHHX-WORMITQPSA-N
Mol Weight 305.27 g/mol
Molecular Formula C14H142DF3O4
Exact Mass 305.09852 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 Hlr7DqBAdhJ
Name Ethyl 2-deuterio-4-(4'-methoxyphenyl)-2-(trifluoromethyl)-4-oxobutanoate
Alternate Name(s) Benzenebutanoic acid, 4-methoxy-.gamma.-oxo-.alpha.-(trifluoromethyl)-, ethyl ester Ethyl 4-(4'-methoxyphenyl)-2-(trifluoromethyl)-4-oxobutanoate
CAS Registry Number 126459-94-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14DF3O4
InChI InChI=1S/C14H15F3O4/c1-3-21-13(19)11(14(15,16)17)8-12(18)9-4-6-10(20-2)7-5-9/h4-7,11H,3,8H2,1-2H3/i11D
InChIKey FUUABHWGJHJHHX-WORMITQPSA-N
Molecular Weight 305.271 g/mol
SMILES C(C(F)(F)F)(CC(c1ccc(cc1)OC)=O)(C(=O)OCC)[2D]
SPLASH splash10-000i-1900000000-a7ac7af0477b74f45c8e
Source of Spectrum J-55-3386-7
Wiley ID 1306120