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N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(4-nitrobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide

View entire compound with spectra: 1 NMR

N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(4-nitrobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
SpectraBase Compound ID AYPJGFihjcl
InChI InChI=1S/C27H26N4O7S/c32-24(28-15-19-7-10-22-23(14-19)38-17-37-22)4-2-1-3-12-29-26(33)25-21(11-13-39-25)30(27(29)34)16-18-5-8-20(9-6-18)31(35)36/h5-11,13-14H,1-4,12,15-17H2,(H,28,32)
InChIKey TUUQVSOVDJDHLK-UHFFFAOYSA-N
Mol Weight 550.59 g/mol
Molecular Formula C27H26N4O7S
Exact Mass 550.15222 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GzWTTeFFlQr
Name N-(1,3-benzodioxol-5-ylmethyl)-6-(1-(4-nitrobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 550.152220360 u
Formula C27H26N4O7S
InChI InChI=1S/C27H26N4O7S/c32-24(28-15-19-7-10-22-23(14-19)38-17-37-22)4-2-1-3-12-29-26(33)25-21(11-13-39-25)30(27(29)34)16-18-5-8-20(9-6-18)31(35)36/h5-11,13-14H,1-4,12,15-17H2,(H,28,32)
InChIKey TUUQVSOVDJDHLK-UHFFFAOYSA-N
Molecular Weight 550.586 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6742
Solvent DMSO-d6
Source Vendor ID: NMR/12329085