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1H-Isoindole-1,3(2H)-dione, 2-[[2-(phenylamino)cyclohexyl]amino]-, trans-
SpectraBase Compound ID G5WsmGYGNZL
InChI InChI=1S/C20H21N3O2/c24-19-15-10-4-5-11-16(15)20(25)23(19)22-18-13-7-6-12-17(18)21-14-8-2-1-3-9-14/h1-5,8-11,17-18,21-22H,6-7,12-13H2/t17-,18-/m1/s1
InChIKey QGMUORSMFQBFDR-QZTJIDSGSA-N
Mol Weight 335.41 g/mol
Molecular Formula C20H21N3O2
Exact Mass 335.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1T9kRaNbaT
Name 1H-Isoindole-1,3(2H)-dione, 2-[[2-(phenylamino)cyclohexyl]amino]-, trans-
Alternate Name(s) 2-{[(1R,2R)-2-anilinocyclohexyl]amino}-1H-isoindole-1,3(2H)-dione N'-(trans-2-anilinocyclohexyl)phthalohydrazid
CAS Registry Number 96185-67-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O2
InChI InChI=1S/C20H21N3O2/c24-19-15-10-4-5-11-16(15)20(25)23(19)22-18-13-7-6-12-17(18)21-14-8-2-1-3-9-14/h1-5,8-11,17-18,21-22H,6-7,12-13H2/t17-,18-/m1/s1
InChIKey QGMUORSMFQBFDR-QZTJIDSGSA-N
Molecular Weight 335.407 g/mol
SMILES N(N1C(c2ccccc2C1=O)=O)[C@]1([C@](Nc2ccccc2)(CCCC1)[H])[H]
SPLASH splash10-000b-7911000000-7d2843ef0304a72b9a86
Source of Spectrum H-68-225-6
Wiley ID 1331774