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methyl {3-[(1Z)-2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-1H-indol-1-yl}acetate
SpectraBase Compound ID It5ipA9cxWl
InChI InChI=1S/C21H15Cl2N3O3/c1-29-19(27)12-26-11-14(15-5-2-3-8-18(15)26)9-13(10-24)21(28)25-17-7-4-6-16(22)20(17)23/h2-9,11H,12H2,1H3,(H,25,28)/b13-9-
InChIKey UUGHNDHFQFFXNP-LCYFTJDESA-N
Mol Weight 428.28 g/mol
Molecular Formula C21H15Cl2N3O3
Exact Mass 427.049047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1J8JfdeQ5eS
Name methyl {3-[(1Z)-2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-1H-indol-1-yl}acetate
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/C21H15Cl2N3O3/c1-29-19(27)12-26-11-14(15-5-2-3-8-18(15)26)9-13(10-24)21(28)25-17-7-4-6-16(22)20(17)23/h2-9,11H,12H2,1H3,(H,25,28)/b13-9-
InChIKey UUGHNDHFQFFXNP-LCYFTJDESA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14178
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: UZI/1011088; UBI_ID: UBI-014181
Synonyms methyl {3-[2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-1H-indol-1-yl}acetate
Temperature 300 °C