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

*Links on SpectraBase are not permalinks.
2-hydroxy-5-oxo-4-p-tolyl-2-trifluoromethyl-3,4,5,6,7,8-hexahydro-2H-chromene-3-carboxylic acid ethyl ester
SpectraBase Compound ID KxbQ5s0Hg2B
InChI InChI=1S/C20H21F3O5/c1-3-27-18(25)17-15(12-9-7-11(2)8-10-12)16-13(24)5-4-6-14(16)28-19(17,26)20(21,22)23/h7-10,15,17,26H,3-6H2,1-2H3
InChIKey FWKSCIYJZPJUAC-UHFFFAOYSA-N
Mol Weight 398.38 g/mol
Molecular Formula C20H21F3O5
Exact Mass 398.134108 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 UcpEejX4Pw
Name 2-hydroxy-5-oxo-4-p-tolyl-2-trifluoromethyl-3,4,5,6,7,8-hexahydro-2H-chromene-3-carboxylic acid ethyl ester
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F3O5
InChI InChI=1S/C20H21F3O5/c1-3-27-18(25)17-15(12-9-7-11(2)8-10-12)16-13(24)5-4-6-14(16)28-19(17,26)20(21,22)23/h7-10,15,17,26H,3-6H2,1-2H3
InChIKey FWKSCIYJZPJUAC-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 398.378 g/mol
SMILES OC1(C(C(C=2C(CCCC2O1)=O)c1ccc(cc1)C)C(=O)OCC)C(F)(F)F
SPLASH splash10-0002-0900000000-6af672920ad68ff865e4
Source of Spectrum CN103992301A
Wiley ID 1849726