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10-phenylamino-9-(2-chlorophenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione
SpectraBase Compound ID BfMvTOPz0WR
InChI InChI=1S/C37H31ClN2O2/c38-30-19-11-10-18-29(30)35-36-31(20-26(22-33(36)41)24-12-4-1-5-13-24)40(39-28-16-8-3-9-17-28)32-21-27(23-34(42)37(32)35)25-14-6-2-7-15-25/h1-19,26-27,35,39H,20-23H2
InChIKey QRGOTRABIGWRFU-UHFFFAOYSA-N
Mol Weight 571.1 g/mol
Molecular Formula C37H31ClN2O2
Exact Mass 570.207406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWnPtpSV1Sh
Name 10-phenylamino-9-(2-chlorophenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione
Alternate Name(s) 10-anilino-9-(2-chlorophenyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione 9-(2-chlorophenyl)-3,6-diphenyl-10-phenylazanyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H31ClN2O2
InChI InChI=1S/C37H31ClN2O2/c38-30-19-11-10-18-29(30)35-36-31(20-26(22-33(36)41)24-12-4-1-5-13-24)40(39-28-16-8-3-9-17-28)32-21-27(23-34(42)37(32)35)25-14-6-2-7-15-25/h1-19,26-27,35,39H,20-23H2
InChIKey QRGOTRABIGWRFU-UHFFFAOYSA-N
Molecular Weight 571.120 g/mol
SMILES N(N1C2=C(C(=O)CC(C2)c2ccccc2)C(C2=C1CC(CC2=O)c1ccccc1)c1c(Cl)cccc1)c1ccccc1
SPLASH splash10-00di-0000090000-c539f9b48083ab1c520c
Source of Spectrum Y-49-199-4k
Wiley ID 1706588