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2-[(4-bromobenzyl)sulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
SpectraBase Compound ID HiOfHAWpLHR
InChI InChI=1S/C16H13BrN2S/c17-14-6-4-11(5-7-14)10-20-16-13(9-18)8-12-2-1-3-15(12)19-16/h4-8H,1-3,10H2
InChIKey CKSUVYJFIXDPPF-UHFFFAOYSA-N
Mol Weight 345.26 g/mol
Molecular Formula C16H13BrN2S
Exact Mass 343.998283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fhmd5Nyrkph
Name 2-[(4-bromobenzyl)sulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
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/C16H13BrN2S/c17-14-6-4-11(5-7-14)10-20-16-13(9-18)8-12-2-1-3-15(12)19-16/h4-8H,1-3,10H2
InChIKey CKSUVYJFIXDPPF-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_753
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: ZI/8163150; Labnumber: NKS-0000028
Temperature 303 °C