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(3Z)-1-[(4-benzhydryl-1-piperazinyl)methyl]-3-[(3-chloro-4-methylphenyl)imino]-1,3-dihydro-2H-indol-2-one
SpectraBase Compound ID BVRDMsJueSX
InChI InChI=1S/C33H31ClN4O/c1-24-16-17-27(22-29(24)34)35-31-28-14-8-9-15-30(28)38(33(31)39)23-36-18-20-37(21-19-36)32(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-17,22,32H,18-21,23H2,1H3/b35-31-
InChIKey IKMLUDLWYVZIFJ-LLZINOMRSA-N
Mol Weight 535.1 g/mol
Molecular Formula C33H31ClN4O
Exact Mass 534.218639 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HeHnvm0SF6X
Name (3Z)-1-[(4-benzhydryl-1-piperazinyl)methyl]-3-[(3-chloro-4-methylphenyl)imino]-1,3-dihydro-2H-indol-2-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C33H31ClN4O/c1-24-16-17-27(22-29(24)34)35-31-28-14-8-9-15-30(28)38(33(31)39)23-36-18-20-37(21-19-36)32(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-17,22,32H,18-21,23H2,1H3/b35-31-
InChIKey IKMLUDLWYVZIFJ-LLZINOMRSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9520
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D47219; Labnumber: SPYK-1185; SBI_ID: SBI-009523
Synonyms 1-[(4-benzhydryl-1-piperazinyl)methyl]-3-[(3-chloro-4-methylphenyl)imino]-1,3-dihydro-2H-indol-2-one
Temperature 308 °C