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

*Links on SpectraBase are not permalinks.
trans, cis-1-(4-chlorophenyl)-3-methyl-2,6-bis(4-nitrophenyl)piperidin-4-one
SpectraBase Compound ID JIrFW0NwGls
InChI InChI=1S/C24H20ClN3O5/c1-15-23(29)14-22(16-2-8-20(9-3-16)27(30)31)26(19-12-6-18(25)7-13-19)24(15)17-4-10-21(11-5-17)28(32)33/h2-13,15,22,24H,14H2,1H3/t15-,22+,24-/m0/s1
InChIKey KOJIWIRRAUCPKL-AMOXOZGRSA-N
Mol Weight 465.89 g/mol
Molecular Formula C24H20ClN3O5
Exact Mass 465.109148 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 KeuZjU1wzaf
Name trans, cis-1-(4-chlorophenyl)-3-methyl-2,6-bis(4-nitrophenyl)piperidin-4-one
Alternate Name(s) (2S,3R,6R)-1-(4-chlorophenyl)-3-methyl-2,6-bis(4-nitrophenyl)piperidin-4-one (2S,3R,6R)-1-(4-chlorophenyl)-3-methyl-2,6-bis(4-nitrophenyl)-4-piperidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20ClN3O5
InChI InChI=1S/C24H20ClN3O5/c1-15-23(29)14-22(16-2-8-20(9-3-16)27(30)31)26(19-12-6-18(25)7-13-19)24(15)17-4-10-21(11-5-17)28(32)33/h2-13,15,22,24H,14H2,1H3/t15-,22+,24-/m0/s1
InChIKey KOJIWIRRAUCPKL-AMOXOZGRSA-N
Literature Reference DOI 10.1002/adsc.201000760
Molecular Weight 465.893 g/mol
SMILES [C@]1(N([C@](CC([C@@]1(C)[H])=O)(c1ccc(cc1)[N+](=O)[O-])[H])c1ccc(cc1)Cl)(c1ccc(cc1)[N+](=O)[O-])[H]
SPLASH splash10-004i-7490000000-719789c342aa5a8a4544
Source of Spectrum ASC-353-315/SM4-3c
Wiley ID 1764713