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3-allyl-2-[(4-isopropoxybenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 5ymBy0MWyqV
InChI InChI=1S/C23H26N2O2S2/c1-4-13-25-22(26)20-18-7-5-6-8-19(18)29-21(20)24-23(25)28-14-16-9-11-17(12-10-16)27-15(2)3/h4,9-12,15H,1,5-8,13-14H2,2-3H3
InChIKey KRMDQFQNFORMDD-UHFFFAOYSA-N
Mol Weight 426.59 g/mol
Molecular Formula C23H26N2O2S2
Exact Mass 426.14357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I9ySr7RUbjp
Name 3-allyl-2-[(4-isopropoxybenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.143570431 u
Formula C23H26N2O2S2
InChI InChI=1S/C23H26N2O2S2/c1-4-13-25-22(26)20-18-7-5-6-8-19(18)29-21(20)24-23(25)28-14-16-9-11-17(12-10-16)27-15(2)3/h4,9-12,15H,1,5-8,13-14H2,2-3H3
InChIKey KRMDQFQNFORMDD-UHFFFAOYSA-N
Molecular Weight 426.593 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2093
Solvent DMSO-d6
Source Vendor ID: NMR/12278884