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2-Amino-4-(4-chlorophenyl)-3-(piperidine-1-carbonyl)-5,5-bis(p-tolyl)cyclopentene-1-carbonitrile
SpectraBase Compound ID 8k2RhZML76s
InChI InChI=1S/C32H32ClN3O/c1-21-6-12-24(13-7-21)32(25-14-8-22(2)9-15-25)27(20-34)30(35)28(31(37)36-18-4-3-5-19-36)29(32)23-10-16-26(33)17-11-23/h6-17,28-29H,3-5,18-19,35H2,1-2H3
InChIKey XZYIQVMQFPILCQ-UHFFFAOYSA-N
Mol Weight 510.1 g/mol
Molecular Formula C32H32ClN3O
Exact Mass 509.22339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNYtfnOup3N
Name 2-Amino-4-(4-chlorophenyl)-3-(piperidine-1-carbonyl)-5,5-bis(p-tolyl)cyclopentene-1-carbonitrile
Alternate Name(s) 2-Amino-4-(4-chlorophenyl)-5,5-bis(4-methylphenyl)-3-(piperidine-1-carbonyl)cyclopentene-1-carbonitrile 2-Amino-4-(4-chlorophenyl)-5,5-bis(4-methylphenyl)-3-[oxo(1-piperidinyl)methyl]-1-cyclopentenecarbonitrile 2-Azanyl-4-(4-chlorophenyl)-5,5-bis(4-methylphenyl)-3-piperidin-1-ylcarbonyl-cyclopentene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H32ClN3O
InChI InChI=1S/C32H32ClN3O/c1-21-6-12-24(13-7-21)32(25-14-8-22(2)9-15-25)27(20-34)30(35)28(31(37)36-18-4-3-5-19-36)29(32)23-10-16-26(33)17-11-23/h6-17,28-29H,3-5,18-19,35H2,1-2H3
InChIKey XZYIQVMQFPILCQ-UHFFFAOYSA-N
Molecular Weight 510.081 g/mol
SMILES NC=1C(C(N2CCCCC2)=O)C(C(C1C#N)(c1ccc(cc1)C)c1ccc(cc1)C)c1ccc(cc1)Cl
SPLASH splash10-00kf-9201000000-50a6a517ca6072b90290
Source of Spectrum SK-32-1896-5
Wiley ID 1548736