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1H-isoindole-1,3(2H)-dione, 2-[2-[(6,7-dihydro-2-methyl-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]ethyl]-
SpectraBase Compound ID HbkIKuUrMQe
InChI InChI=1S/C20H17N3O2S2/c1-11-21-17(16-14-7-4-8-15(14)27-18(16)22-11)26-10-9-23-19(24)12-5-2-3-6-13(12)20(23)25/h2-3,5-6H,4,7-10H2,1H3
InChIKey KFUIYOUFVDLYAY-UHFFFAOYSA-N
Mol Weight 395.5 g/mol
Molecular Formula C20H17N3O2S2
Exact Mass 395.076219 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HJ5qnVx5YUH
Name 1H-isoindole-1,3(2H)-dione, 2-[2-[(6,7-dihydro-2-methyl-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]ethyl]-
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/C20H17N3O2S2/c1-11-21-17(16-14-7-4-8-15(14)27-18(16)22-11)26-10-9-23-19(24)12-5-2-3-6-13(12)20(23)25/h2-3,5-6H,4,7-10H2,1H3
InChIKey KFUIYOUFVDLYAY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_993
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/11228711