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ethyl [(3-benzyl-6-isopropyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
SpectraBase Compound ID HbesM4BC2Zu
InChI InChI=1S/C23H26N2O4S2/c1-4-28-19(26)13-30-23-24-21-20(16-10-17(14(2)3)29-12-18(16)31-21)22(27)25(23)11-15-8-6-5-7-9-15/h5-9,14,17H,4,10-13H2,1-3H3
InChIKey VUAWYXMENBVDAX-UHFFFAOYSA-N
Mol Weight 458.59 g/mol
Molecular Formula C23H26N2O4S2
Exact Mass 458.1334 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DGC2JKj2UYU
Name ethyl [(3-benzyl-6-isopropyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.133399669 u
Formula C23H26N2O4S2
InChI InChI=1S/C23H26N2O4S2/c1-4-28-19(26)13-30-23-24-21-20(16-10-17(14(2)3)29-12-18(16)31-21)22(27)25(23)11-15-8-6-5-7-9-15/h5-9,14,17H,4,10-13H2,1-3H3
InChIKey VUAWYXMENBVDAX-UHFFFAOYSA-N
Molecular Weight 458.591 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1991
Solvent DMSO-d6
Source Vendor ID: NMR/12278753