For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-[(3-bromobenzyl)sulfanyl]-3-(3-isopropoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 9IBjwpWoO1Q
InChI InChI=1S/C23H23BrN2O2S2/c1-15(2)28-12-6-11-26-22(27)21-20(18-9-3-4-10-19(18)30-21)25-23(26)29-14-16-7-5-8-17(24)13-16/h3-5,7-10,13,15H,6,11-12,14H2,1-2H3
InChIKey AFHFMTMNCBYFPJ-UHFFFAOYSA-N
Mol Weight 503.47 g/mol
Molecular Formula C23H23BrN2O2S2
Exact Mass 502.038433 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID H4sE20cJ9Lv
Name 2-[(3-bromobenzyl)sulfanyl]-3-(3-isopropoxypropyl)[1]benzothieno[3,2-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 502.038433335 u
Formula C23H23BrN2O2S2
InChI InChI=1S/C23H23BrN2O2S2/c1-15(2)28-12-6-11-26-22(27)21-20(18-9-3-4-10-19(18)30-21)25-23(26)29-14-16-7-5-8-17(24)13-16/h3-5,7-10,13,15H,6,11-12,14H2,1-2H3
InChIKey AFHFMTMNCBYFPJ-UHFFFAOYSA-N
Molecular Weight 503.473 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6258
Solvent DMSO-d6
Source Vendor ID: NMR/12328357