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1-BENZYL-6-(4-CHLOROPHENYL)-2-(4-NITROPHENYL)-4-(4-NITROSTYRYL)-2,3-DIHYDROPYRAZOLO-[3,4-B][1,4]-DIAZEPINE
SpectraBase Compound ID 7QNso7Po0MB
InChI InChI=1S/C33H25ClN6O4/c34-26-13-9-25(10-14-26)31-32-33(37-36-31)38(21-23-4-2-1-3-5-23)30(24-11-18-29(19-12-24)40(43)44)20-27(35-32)15-6-22-7-16-28(17-8-22)39(41)42/h1-19,30H,20-21H2,(H,36,37)/b15-6+
InChIKey ZLQBJMFMDKTQAK-GIDUJCDVSA-N
Mol Weight 605.1 g/mol
Molecular Formula C33H25ClN6O4
Exact Mass 604.162581 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVLXVL6eOGO
Name 1-BENZYL-6-(4-CHLOROPHENYL)-2-(4-NITROPHENYL)-4-(4-NITROSTYRYL)-2,3-DIHYDROPYRAZOLO-[3,4-B][1,4]-DIAZEPINE
Compound Number 3C
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H25ClN6O4
InChI InChI=1S/C33H25ClN6O4/c34-26-13-9-25(10-14-26)31-32-33(37-36-31)38(21-23-4-2-1-3-5-23)30(24-11-18-29(19-12-24)40(43)44)20-27(35-32)15-6-22-7-16-28(17-8-22)39(41)42/h1-19,30H,20-21H2,(H,36,37)/b15-6+
InChIKey ZLQBJMFMDKTQAK-GIDUJCDVSA-N
Literature Reference Author B.INSUASTY,R.RODRIGUEZ,J.QUIROGA,R.ABONIA,R.MARTINEZ,A.TOSCA NO,E.ANGELES
Literature Reference Citation MOLECULES,6,710(2001)
Literature Reference DOI 10.3390/60800710
Molecular Weight 605.052 g/mol
Solvent DMSO-D6
Source File Reference UWLU7619