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

*Links on SpectraBase are not permalinks.
4-(2'-Hydroxy-4',4'-dimethyl-6'-oxo-cyclohex-1'-en-1'-yl)-3-nitro-8-phenylquinolin-2(1H)-one
SpectraBase Compound ID EfwEDSqvlTg
InChI InChI=1S/C23H20N2O5/c1-23(2)11-16(26)19(17(27)12-23)18-15-10-6-9-14(13-7-4-3-5-8-13)20(15)24-22(28)21(18)25(29)30/h3-10,26H,11-12H2,1-2H3,(H,24,28)
InChIKey LTFVFBGRUGYFRF-UHFFFAOYSA-N
Mol Weight 404.42 g/mol
Molecular Formula C23H20N2O5
Exact Mass 404.137222 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 2G5Ml8vVI8h
Name 4-(2'-Hydroxy-4',4'-dimethyl-6'-oxo-cyclohex-1'-en-1'-yl)-3-nitro-8-phenylquinolin-2(1H)-one
Alternate Name(s) 4-(2'-Hydroxy-4',4'-dimethyl-6'-oxo-cyclohex-1'-en-1'-yl)-3-nitro-1-phenylquinolin-2(1H)-one 4-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-nitro-8-phenyl-2(1H)-quinolinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20N2O5
InChI InChI=1S/C23H20N2O5/c1-23(2)11-16(26)19(17(27)12-23)18-15-10-6-9-14(13-7-4-3-5-8-13)20(15)24-22(28)21(18)25(29)30/h3-10,26H,11-12H2,1-2H3,(H,24,28)
InChIKey LTFVFBGRUGYFRF-UHFFFAOYSA-N
Molecular Weight 404.422 g/mol
SMILES OC1=C(C2=C(C(Nc3c(cccc23)-c2ccccc2)=O)N(=O)=O)C(CC(C1)(C)C)=O
SPLASH splash10-0udi-0000900000-c150c14e0bf25843363a
Source of Spectrum AJ-43-123-8
Wiley ID 1593809