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1-Phenyl-3-methyl-5-(methoxycarbonyl)-6-[(4-methylphenylamino)(4-methylphenylimino)methyl]-7-methoxy)pyrazolo[3,4-d][1,3]diazepine

View entire compound with spectra: 1 MS (GC)

1-Phenyl-3-methyl-5-(methoxycarbonyl)-6-[(4-methylphenylamino)(4-methylphenylimino)methyl]-7-methoxy)pyrazolo[3,4-d][1,3]diazepine
SpectraBase Compound ID 3SJa8PYiFS9
InChI InChI=1S/C31H30N6O3/c1-20-11-15-23(16-12-20)32-30(33-24-17-13-21(2)14-18-24)36-27(29(38)39-4)19-26-22(3)35-37(25-9-7-6-8-10-25)28(26)34-31(36)40-5/h6-19H,1-5H3,(H,32,33)
InChIKey GCSRMSJVAIFNEL-UHFFFAOYSA-N
Mol Weight 534.62 g/mol
Molecular Formula C31H30N6O3
Exact Mass 534.237939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AtPctK7w8
Name 1-Phenyl-3-methyl-5-(methoxycarbonyl)-6-[(4-methylphenylamino)(4-methylphenylimino)methyl]-7-methoxy)pyrazolo[3,4-d][1,3]diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H30N6O3
InChI InChI=1S/C31H30N6O3/c1-20-11-15-23(16-12-20)32-30(33-24-17-13-21(2)14-18-24)36-27(29(38)39-4)19-26-22(3)35-37(25-9-7-6-8-10-25)28(26)34-31(36)40-5/h6-19H,1-5H3,(H,32,33)
InChIKey GCSRMSJVAIFNEL-UHFFFAOYSA-N
Molecular Weight 534.620 g/mol
SMILES N(\C(N1C(=Nc2c(C=C1C(=O)OC)c(C)n[n]2-c1ccccc1)OC)=N/c1ccc(cc1)C)c1ccc(cc1)C
SPLASH splash10-0036-9010040000-b1384c0760850dc160ff
Source of Spectrum J-58-5270-21
Synonyms Methyl 7-methoxy-3-methyl-6-[(E)-[(4-methylphenyl)imino](4-toluidino)methyl]-1-phenyl-1,6-dihydropyrazolo[3,4-d][1,3]diazepine-5-carboxylate
Wiley ID 1403843