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acetonitrile, [[3,4,5,6,7,8-hexahydro-3-(4-methylphenyl)-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl]thio]-
SpectraBase Compound ID NWmGQHvodY
InChI InChI=1S/C19H17N3OS2/c1-12-6-8-13(9-7-12)22-18(23)16-14-4-2-3-5-15(14)25-17(16)21-19(22)24-11-10-20/h6-9H,2-5,11H2,1H3
InChIKey UEDFWPHUTWZFSP-UHFFFAOYSA-N
Mol Weight 367.49 g/mol
Molecular Formula C19H17N3OS2
Exact Mass 367.081305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1tK188NI0M4
Name acetonitrile, [[3,4,5,6,7,8-hexahydro-3-(4-methylphenyl)-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.081304526 u
Formula C19H17N3OS2
InChI InChI=1S/C19H17N3OS2/c1-12-6-8-13(9-7-12)22-18(23)16-14-4-2-3-5-15(14)25-17(16)21-19(22)24-11-10-20/h6-9H,2-5,11H2,1H3
InChIKey UEDFWPHUTWZFSP-UHFFFAOYSA-N
Molecular Weight 367.485 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10884
Solvent DMSO-d6
Source Vendor ID: NMR/9216046; Lab Info: ART; Lab Number: ART-MPV0065