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isopropyl 4-cyano-3-methyl-5-[(phenylacetyl)amino]-2-thiophenecarboxylate
SpectraBase Compound ID 7j1rcekwu84
InChI InChI=1S/C18H18N2O3S/c1-11(2)23-18(22)16-12(3)14(10-19)17(24-16)20-15(21)9-13-7-5-4-6-8-13/h4-8,11H,9H2,1-3H3,(H,20,21)
InChIKey QXUTYEONZMCXCQ-UHFFFAOYSA-N
Mol Weight 342.41 g/mol
Molecular Formula C18H18N2O3S
Exact Mass 342.103814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KE1tk4M6B5H
Name isopropyl 4-cyano-3-methyl-5-[(phenylacetyl)amino]-2-thiophenecarboxylate
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/C18H18N2O3S/c1-11(2)23-18(22)16-12(3)14(10-19)17(24-16)20-15(21)9-13-7-5-4-6-8-13/h4-8,11H,9H2,1-3H3,(H,20,21)
InChIKey QXUTYEONZMCXCQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_14353
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/9055049; Labnumber: NSB0063044; UZI_ID: UZI-014357
Temperature 318 °C