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N-{[(1R,2S)-2-{[(2,2-Dimethylpropionylimino)phenylmethyl]amino}-cyclohexylamino]phenylmethylidene}-2,2-dimethylpropionamide

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N-{[(1R,2S)-2-{[(2,2-Dimethylpropionylimino)phenylmethyl]amino}-cyclohexylamino]phenylmethylidene}-2,2-dimethylpropionamide
SpectraBase Compound ID IxyexibkS7r
InChI InChI=1S/C30H40N4O2/c1-29(2,3)27(35)33-25(21-15-9-7-10-16-21)31-23-19-13-14-20-24(23)32-26(22-17-11-8-12-18-22)34-28(36)30(4,5)6/h7-12,15-18,23-24H,13-14,19-20H2,1-6H3,(H,31,33,35)(H,32,34,36)/t23-,24+
InChIKey PDQBJTDRQRSPOS-PSWAGMNNSA-N
Mol Weight 488.7 g/mol
Molecular Formula C30H40N4O2
Exact Mass 488.315127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qHcBSFJqt0
Name N-{[(1R,2S)-2-{[(2,2-Dimethylpropionylimino)phenylmethyl]amino}-cyclohexylamino]phenylmethylidene}-2,2-dimethylpropionamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40N4O2
InChI InChI=1S/C30H40N4O2/c1-29(2,3)27(35)33-25(21-15-9-7-10-16-21)31-23-19-13-14-20-24(23)32-26(22-17-11-8-12-18-22)34-28(36)30(4,5)6/h7-12,15-18,23-24H,13-14,19-20H2,1-6H3,(H,31,33,35)(H,32,34,36)/t23-,24+
InChIKey PDQBJTDRQRSPOS-PSWAGMNNSA-N
Molecular Weight 488.676 g/mol
SMILES N(\C(=N\C(C(C)(C)C)=O)c1ccccc1)[C@]1([C@@](N\C(=N\C(C(C)(C)C)=O)c2ccccc2)(CCCC1)[H])[H]
SPLASH splash10-001i-4330900000-ce050300908579cdcdd5
Source of Spectrum U1-2011-3204-7h
Wiley ID 1665467