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N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)isonicotinamide

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N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)isonicotinamide
SpectraBase Compound ID 79MpeXhAaNa
InChI InChI=1S/C20H23N3OS/c1-4-20(2,3)14-5-6-15-16(12-21)19(25-17(15)11-14)23-18(24)13-7-9-22-10-8-13/h7-10,14H,4-6,11H2,1-3H3,(H,23,24)
InChIKey XTIRJRPCHKZKRW-UHFFFAOYSA-N
Mol Weight 353.48 g/mol
Molecular Formula C20H23N3OS
Exact Mass 353.156184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID COqZuSQ8Zmo
Name N-(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)isonicotinamide
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/C20H23N3OS/c1-4-20(2,3)14-5-6-15-16(12-21)19(25-17(15)11-14)23-18(24)13-7-9-22-10-8-13/h7-10,14H,4-6,11H2,1-3H3,(H,23,24)
InChIKey XTIRJRPCHKZKRW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1568
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/8023008; UBI_ID: UBI-001569
Temperature 318 °C