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1H-pyrazole-3-acetonitrile, 5-amino-alpha-[[3-[(2-chlorophenyl)methoxy]phenyl]methylene]-4-cyano-1-(2-hydroxyethyl)-
SpectraBase Compound ID B78e7fBwVEt
InChI InChI=1S/C22H18ClN5O2/c23-20-7-2-1-5-16(20)14-30-18-6-3-4-15(11-18)10-17(12-24)21-19(13-25)22(26)28(27-21)8-9-29/h1-7,10-11,29H,8-9,14,26H2/b17-10+
InChIKey ATVPNKZTOKISEU-LICLKQGHSA-N
Mol Weight 419.87 g/mol
Molecular Formula C22H18ClN5O2
Exact Mass 419.114903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2UYNFYeShUr
Name 1H-pyrazole-3-acetonitrile, 5-amino-alpha-[[3-[(2-chlorophenyl)methoxy]phenyl]methylene]-4-cyano-1-(2-hydroxyethyl)-
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/C22H18ClN5O2/c23-20-7-2-1-5-16(20)14-30-18-6-3-4-15(11-18)10-17(12-24)21-19(13-25)22(26)28(27-21)8-9-29/h1-7,10-11,29H,8-9,14,26H2/b17-10+
InChIKey ATVPNKZTOKISEU-LICLKQGHSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3845
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: NMR/11318034