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

*Links on SpectraBase are not permalinks.
(E)-Dimethyl 2-(4-trifluoromethyl)benzylidene)succinate
SpectraBase Compound ID 8jnIrDjicL0
InChI InChI=1S/C14H13F3O4/c1-20-12(18)8-10(13(19)21-2)7-9-3-5-11(6-4-9)14(15,16)17/h3-7H,8H2,1-2H3/b10-7+
InChIKey XWHFQQCABPMBQW-JXMROGBWSA-N
Mol Weight 302.25 g/mol
Molecular Formula C14H13F3O4
Exact Mass 302.076593 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 2VekLHon61V
Name (E)-Dimethyl 2-(4-(trifluoromethyl)benzylidene) succinate
Appearance Yellowish oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.076593384 u
Formula C14H13F3O4
InChI InChI=1S/C14H13F3O4/c1-20-12(18)8-10(13(19)21-2)7-9-3-5-11(6-4-9)14(15,16)17/h3-7H,8H2,1-2H3/b10-7+
InChIKey XWHFQQCABPMBQW-JXMROGBWSA-N
Instrument Name Agilent 5975C inert XL
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503744
Molecular Weight 302.249 g/mol
Quality 577
Reported Formula C14H13F3O4
SMILES C=1C(=CC=C(\C=C\(C(=O)OC)CC(=O)OC)C1)C(F)(F)F
SPLASH splash10-05ur-1940000000-7ba0e35a80c114b15592
Source of Spectrum QE-22-SM12-3ap (DOI: 10.1002/chem.201503744)
Thin-Layer Chromatography 0.51 (SiO2, CH/EtOAc, 2:1)
Wiley ID 1903602