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5-Phenyl-4,4-di[p-Tolyl]-2-amino-3-cyanocyclopent-2-ene-1-(N,N-diethyl)carbamide
SpectraBase Compound ID I89PntDtdUa
InChI InChI=1S/C31H33N3O/c1-5-34(6-2)30(35)27-28(23-10-8-7-9-11-23)31(26(20-32)29(27)33,24-16-12-21(3)13-17-24)25-18-14-22(4)15-19-25/h7-19,27-28H,5-6,33H2,1-4H3
InChIKey NPIQNWNEQMHSQI-UHFFFAOYSA-N
Mol Weight 463.6 g/mol
Molecular Formula C31H33N3O
Exact Mass 463.262363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7EsCm1mZRHa
Name 5-Phenyl-4,4-di[p-Tolyl]-2-amino-3-cyanocyclopent-2-ene-1-(N,N-diethyl)carbamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H33N3O
InChI InChI=1S/C31H33N3O/c1-5-34(6-2)30(35)27-28(23-10-8-7-9-11-23)31(26(20-32)29(27)33,24-16-12-21(3)13-17-24)25-18-14-22(4)15-19-25/h7-19,27-28H,5-6,33H2,1-4H3
InChIKey NPIQNWNEQMHSQI-UHFFFAOYSA-N
Molecular Weight 463.625 g/mol
SMILES NC=1C(C(N(CC)CC)=O)C(C(C1C#N)(c1ccc(cc1)C)c1ccc(cc1)C)c1ccccc1
SPLASH splash10-03xx-9103000000-da4cc4cf2ec5c125c70f
Source of Spectrum SK-32-1896-5h
Wiley ID 882554