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benzo[b]thiophene-3-carboxylic acid, 2-[[(2Z)-2-cyano-3-[5-(4-methylphenyl)-2-furanyl]-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro-, ethyl
SpectraBase Compound ID 2urGCgKHufI
InChI InChI=1S/C26H24N2O4S/c1-3-31-26(30)23-20-6-4-5-7-22(20)33-25(23)28-24(29)18(15-27)14-19-12-13-21(32-19)17-10-8-16(2)9-11-17/h8-14H,3-7H2,1-2H3,(H,28,29)/b18-14-
InChIKey CVPBPEFGJYPECO-JXAWBTAJSA-N
Mol Weight 460.55 g/mol
Molecular Formula C26H24N2O4S
Exact Mass 460.145678 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4PkXMgsxu72
Name benzo[b]thiophene-3-carboxylic acid, 2-[[(2Z)-2-cyano-3-[5-(4-methylphenyl)-2-furanyl]-1-oxo-2-propenyl]amino]-4,5,6,7-tetrahydro-, ethyl
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.145678431 u
Formula C26H24N2O4S
InChI InChI=1S/C26H24N2O4S/c1-3-31-26(30)23-20-6-4-5-7-22(20)33-25(23)28-24(29)18(15-27)14-19-12-13-21(32-19)17-10-8-16(2)9-11-17/h8-14H,3-7H2,1-2H3,(H,28,29)/b18-14-
InChIKey CVPBPEFGJYPECO-JXAWBTAJSA-N
Molecular Weight 460.548 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9204
Solvent DMSO-d6
Source Vendor ID: NMR/9245030; Lab Info: OBU; Lab Number: OBU-B000007