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pyrrolo[3,4-e][1,4]diazepin-8(1H)-one, 5-(4-chlorophenyl)-2,3,6,7-tetrahydro-6-(4-methoxyphenyl)-7-phenyl-
SpectraBase Compound ID GC32imYZRNB
InChI InChI=1S/C26H22ClN3O2/c1-32-21-13-9-18(10-14-21)25-22-23(17-7-11-19(27)12-8-17)28-15-16-29-24(22)26(31)30(25)20-5-3-2-4-6-20/h2-14,25,29H,15-16H2,1H3
InChIKey OJPWDHVQYPAPNI-UHFFFAOYSA-N
Mol Weight 443.93 g/mol
Molecular Formula C26H22ClN3O2
Exact Mass 443.140055 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lqicly4Oe87
Name pyrrolo[3,4-e][1,4]diazepin-8(1H)-one, 5-(4-chlorophenyl)-2,3,6,7-tetrahydro-6-(4-methoxyphenyl)-7-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.140054658 u
Formula C26H22ClN3O2
InChI InChI=1S/C26H22ClN3O2/c1-32-21-13-9-18(10-14-21)25-22-23(17-7-11-19(27)12-8-17)28-15-16-29-24(22)26(31)30(25)20-5-3-2-4-6-20/h2-14,25,29H,15-16H2,1H3
InChIKey OJPWDHVQYPAPNI-UHFFFAOYSA-N
Molecular Weight 443.934 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1444
Solvent DMSO-d6
Source Vendor ID: NMR/8267032; Lab Info: MGU; Lab Number: MGU-0004750