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tert-butyl {[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridinyl]sulfanyl}acetate
SpectraBase Compound ID GC5Lp24ScRN
InChI InChI=1S/C22H20N2O2S2/c1-22(2,3)26-20(25)14-28-21-17(13-23)16(19-10-7-11-27-19)12-18(24-21)15-8-5-4-6-9-15/h4-12H,14H2,1-3H3
InChIKey JSKYOFPBZDSNBL-UHFFFAOYSA-N
Mol Weight 408.53 g/mol
Molecular Formula C22H20N2O2S2
Exact Mass 408.09662 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 82EUOwJXwGY
Name tert-butyl {[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridinyl]sulfanyl}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/C22H20N2O2S2/c1-22(2,3)26-20(25)14-28-21-17(13-23)16(19-10-7-11-27-19)12-18(24-21)15-8-5-4-6-9-15/h4-12H,14H2,1-3H3
InChIKey JSKYOFPBZDSNBL-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10479
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: 132557; Labnumber: SHES1-108; VK_ID: VK-010483
Temperature 308 °C