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4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 3,5,6,7-tetrahydro-3-(2-methylphenyl)-2-[(phenylmethyl)thio]-
SpectraBase Compound ID LeurRDnjf8h
InChI InChI=1S/C23H20N2OS2/c1-15-8-5-6-12-18(15)25-22(26)20-17-11-7-13-19(17)28-21(20)24-23(25)27-14-16-9-3-2-4-10-16/h2-6,8-10,12H,7,11,13-14H2,1H3
InChIKey MHOKQCSVHMDIHZ-UHFFFAOYSA-N
Mol Weight 404.55 g/mol
Molecular Formula C23H20N2OS2
Exact Mass 404.101706 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Gfq8ycJ159
Name 4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 3,5,6,7-tetrahydro-3-(2-methylphenyl)-2-[(phenylmethyl)thio]-
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/C23H20N2OS2/c1-15-8-5-6-12-18(15)25-22(26)20-17-11-7-13-19(17)28-21(20)24-23(25)27-14-16-9-3-2-4-10-16/h2-6,8-10,12H,7,11,13-14H2,1H3
InChIKey MHOKQCSVHMDIHZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_3497
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: NMR/11249500