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N-[3-(aminocarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]-2-chloronicotinamide
SpectraBase Compound ID 1wPDDHp82uI
InChI InChI=1S/C16H16ClN3O2S/c17-13-10(6-4-8-19-13)15(22)20-16-12(14(18)21)9-5-2-1-3-7-11(9)23-16/h4,6,8H,1-3,5,7H2,(H2,18,21)(H,20,22)
InChIKey JXRFAKONUCSMNR-UHFFFAOYSA-N
Mol Weight 349.84 g/mol
Molecular Formula C16H16ClN3O2S
Exact Mass 349.065176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5llM7G4q8d9
Name N-[3-(aminocarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]-2-chloronicotinamide
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/C16H16ClN3O2S/c17-13-10(6-4-8-19-13)15(22)20-16-12(14(18)21)9-5-2-1-3-7-11(9)23-16/h4,6,8H,1-3,5,7H2,(H2,18,21)(H,20,22)
InChIKey JXRFAKONUCSMNR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15787
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/8033017; UBI_ID: UBI-015790
Temperature 318 °C