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(2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-2-propenamide
SpectraBase Compound ID AW1awBJ6zDd
InChI InChI=1S/C26H17ClF3N3O2/c27-22-8-6-19(26(28,29)30)11-24(22)33-25(34)17(13-31)10-18-14-32-23-9-7-20(12-21(18)23)35-15-16-4-2-1-3-5-16/h1-12,14,32H,15H2,(H,33,34)/b17-10+
InChIKey QFRZQMMYVOLNOQ-LICLKQGHSA-N
Mol Weight 495.89 g/mol
Molecular Formula C26H17ClF3N3O2
Exact Mass 495.096139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9sMuD5kvIHm
Name (2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-2-propenamide
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/C26H17ClF3N3O2/c27-22-8-6-19(26(28,29)30)11-24(22)33-25(34)17(13-31)10-18-14-32-23-9-7-20(12-21(18)23)35-15-16-4-2-1-3-5-16/h1-12,14,32H,15H2,(H,33,34)/b17-10+
InChIKey QFRZQMMYVOLNOQ-LICLKQGHSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9053
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: 1001116; UBI_ID: UBI-009056
Synonyms 3-[5-(benzyloxy)-1H-indol-3-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-2-propenamide
Temperature 313 °C