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N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2-chloro-5-methylphenoxy)propanamide
SpectraBase Compound ID Id00zMDvfq1
InChI InChI=1S/C23H27ClN2O2S/c1-13-6-9-18(24)19(10-13)28-14(2)21(27)26-22-17(12-25)16-8-7-15(23(3,4)5)11-20(16)29-22/h6,9-10,14-15H,7-8,11H2,1-5H3,(H,26,27)
InChIKey MCSNZOBIVIMKIB-UHFFFAOYSA-N
Mol Weight 430.99 g/mol
Molecular Formula C23H27ClN2O2S
Exact Mass 430.148177 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KmWkFP2pP67
Name N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2-chloro-5-methylphenoxy)propanamide
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/C23H27ClN2O2S/c1-13-6-9-18(24)19(10-13)28-14(2)21(27)26-22-17(12-25)16-8-7-15(23(3,4)5)11-20(16)29-22/h6,9-10,14-15H,7-8,11H2,1-5H3,(H,26,27)
InChIKey MCSNZOBIVIMKIB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7661
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/1269454; Labnumber: COL5642; UZI_ID: UZI-007663
Temperature 318 °C