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2-(isobutylsulfanyl)-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID DLKqAUgHT0W
InChI InChI=1S/C21H24N2O2S2/c1-13(2)12-26-20-22-18-17(15-10-21(3,4)25-11-16(15)27-18)19(24)23(20)14-8-6-5-7-9-14/h5-9,13H,10-12H2,1-4H3
InChIKey YJMWJGSUTRVRGW-UHFFFAOYSA-N
Mol Weight 400.56 g/mol
Molecular Formula C21H24N2O2S2
Exact Mass 400.12792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 65N4JbvlUSJ
Name 2-(isobutylsulfanyl)-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-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 400.127920367 u
Formula C21H24N2O2S2
InChI InChI=1S/C21H24N2O2S2/c1-13(2)12-26-20-22-18-17(15-10-21(3,4)25-11-16(15)27-18)19(24)23(20)14-8-6-5-7-9-14/h5-9,13H,10-12H2,1-4H3
InChIKey YJMWJGSUTRVRGW-UHFFFAOYSA-N
Molecular Weight 400.555 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2074
Solvent DMSO-d6
Source Vendor ID: NMR/12278846