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2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
SpectraBase Compound ID EBisjLypFRo
InChI InChI=1S/C21H19N3O2S/c22-13-15-11-14-7-3-1-6-10-17(14)23-20(15)27-18-12-19(25)24(21(18)26)16-8-4-2-5-9-16/h2,4-5,8-9,11,18H,1,3,6-7,10,12H2
InChIKey PUKQXAICJCERSH-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C21H19N3O2S
Exact Mass 377.119798 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ZAxJe0iVCz
Name 2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[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/C21H19N3O2S/c22-13-15-11-14-7-3-1-6-10-17(14)23-20(15)27-18-12-19(25)24(21(18)26)16-8-4-2-5-9-16/h2,4-5,8-9,11,18H,1,3,6-7,10,12H2
InChIKey PUKQXAICJCERSH-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18400
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/9122835; UBI_ID: UBI-018403
Temperature 315 °C