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3-quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-7,7-dimethyl-5-oxo-2-thioxo-
SpectraBase Compound ID 3tsLH8ijjoE
InChI InChI=1S/C12H12N2OS/c1-12(2)4-9-8(10(15)5-12)3-7(6-13)11(16)14-9/h3H,4-5H2,1-2H3,(H,14,16)
InChIKey ZVBVJGPOTJDKCP-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C12H12N2OS
Exact Mass 232.067034 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID vejZdjeBZH
Name 3-quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-7,7-dimethyl-5-oxo-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.067034187 u
Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-12(2)4-9-8(10(15)5-12)3-7(6-13)11(16)14-9/h3H,4-5H2,1-2H3,(H,14,16)
InChIKey ZVBVJGPOTJDKCP-UHFFFAOYSA-N
Molecular Weight 232.301 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10588
Solvent DMSO-d6
Source Vendor ID: NMR/10251916; Lab Info: KR; Lab Number: KR-XX00255