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2-Amino-3-[oxo(1-piperidinyl)methyl]-4,5,5-triphenyl-1-cyclopentenecarbonitrile
SpectraBase Compound ID AMesTcIww
InChI InChI=1S/C30H29N3O/c31-21-25-28(32)26(29(34)33-19-11-4-12-20-33)27(22-13-5-1-6-14-22)30(25,23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-3,5-10,13-18,26-27H,4,11-12,19-20,32H2
InChIKey NGSOXECEVIJYBY-UHFFFAOYSA-N
Mol Weight 447.58 g/mol
Molecular Formula C30H29N3O
Exact Mass 447.231063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CA8VffKtuT
Name 2-Amino-3-[oxo(1-piperidinyl)methyl]-4,5,5-triphenyl-1-cyclopentenecarbonitrile
Alternate Name(s) 2-Amino-4,5,5-triphenyl-3-(piperidine-1-carbonyl)cyclopentene-1-carbonitrile 2-Azanyl-4,5,5-triphenyl-3-piperidin-1-ylcarbonyl-cyclopentene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H29N3O
InChI InChI=1S/C30H29N3O/c31-21-25-28(32)26(29(34)33-19-11-4-12-20-33)27(22-13-5-1-6-14-22)30(25,23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-3,5-10,13-18,26-27H,4,11-12,19-20,32H2
InChIKey NGSOXECEVIJYBY-UHFFFAOYSA-N
Molecular Weight 447.582 g/mol
SMILES NC=1C(C(N2CCCCC2)=O)C(C(C1C#N)(c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-00kr-5209200000-a95679ab43302f777a54
Source of Spectrum SK-32-1895-5
Wiley ID 882558