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

*Links on SpectraBase are not permalinks.
4-(2,4-difluoroanilino)-2-keto-6-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid methyl ester
SpectraBase Compound ID 3mVRxQypqpX
InChI InChI=1S/C21H19F2NO4/c1-27-15-6-3-12(4-7-15)16-10-14(11-19(25)20(16)21(26)28-2)24-18-8-5-13(22)9-17(18)23/h3-9,11,16,20,24H,10H2,1-2H3
InChIKey RAJVALZDSQTAET-UHFFFAOYSA-N
Mol Weight 387.38 g/mol
Molecular Formula C21H19F2NO4
Exact Mass 387.128214 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 4aIoH80t64c
Name 4-(2,4-difluoroanilino)-2-keto-6-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid methyl ester
Alternate Name(s) 4-(2,4-difluoroanilino)-6-(4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester Methyl 4-(2,4-difluoroanilino)-6-(4-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate Methyl 4-[[2,4-bis(fluoranyl)phenyl]amino]-6-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19F2NO4
InChI InChI=1S/C21H19F2NO4/c1-27-15-6-3-12(4-7-15)16-10-14(11-19(25)20(16)21(26)28-2)24-18-8-5-13(22)9-17(18)23/h3-9,11,16,20,24H,10H2,1-2H3
InChIKey RAJVALZDSQTAET-UHFFFAOYSA-N
Molecular Weight 387.383 g/mol
SMILES N(C=1CC(C(C(C1)=O)C(=O)OC)c1ccc(cc1)OC)c1ccc(cc1F)F
SPLASH splash10-004j-1913000000-6b30dd7b8d5273c0671d
Wiley ID 1511528