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1,3-bis(Phenylsulfonyl)-4,5-bis(p-methylphenyl)-3-cyanocyclopent-1-ene-2-amine
SpectraBase Compound ID 4AiYAOk0VcK
InChI InChI=1S/C32H28N2O4S2/c1-22-13-17-24(18-14-22)28-29(25-19-15-23(2)16-20-25)32(21-33,40(37,38)27-11-7-4-8-12-27)31(34)30(28)39(35,36)26-9-5-3-6-10-26/h3-20,28-29H,34H2,1-2H3
InChIKey ASSDLPBZKAYLBQ-UHFFFAOYSA-N
Mol Weight 568.7 g/mol
Molecular Formula C32H28N2O4S2
Exact Mass 568.14905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Oq5kz2msaL
Name 1,3-bis(Phenylsulfonyl)-4,5-bis(p-methylphenyl)-3-cyanocyclopent-1-ene-2-amine
Alternate Name(s) 2-Amino-4,5-bis(4-methylphenyl)-1,3-bis(phenylsulfonyl)-2-cyclopentene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28N2O4S2
InChI InChI=1S/C32H28N2O4S2/c1-22-13-17-24(18-14-22)28-29(25-19-15-23(2)16-20-25)32(21-33,40(37,38)27-11-7-4-8-12-27)31(34)30(28)39(35,36)26-9-5-3-6-10-26/h3-20,28-29H,34H2,1-2H3
InChIKey ASSDLPBZKAYLBQ-UHFFFAOYSA-N
Molecular Weight 568.706 g/mol
SMILES NC1=C(C(C(C1(C#N)S(=O)(=O)c1ccccc1)c1ccc(cc1)C)c1ccc(cc1)C)S(=O)(=O)c1ccccc1
SPLASH splash10-004i-9540000000-962497b2580e4f86005f
Source of Spectrum SK-34-271-2
Wiley ID 1582017