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2-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID Fz6MfwjavaN
InChI InChI=1S/C21H20N4O2S/c1-27-16-8-7-13(11-14(16)12-25-10-4-9-22-25)19-23-20(26)18-15-5-2-3-6-17(15)28-21(18)24-19/h4,7-11H,2-3,5-6,12H2,1H3,(H,23,24,26)
InChIKey NARQLVWQIOHFKD-UHFFFAOYSA-N
Mol Weight 392.48 g/mol
Molecular Formula C21H20N4O2S
Exact Mass 392.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KhVDFUGgRLz
Name 2-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H20N4O2S/c1-27-16-8-7-13(11-14(16)12-25-10-4-9-22-25)19-23-20(26)18-15-5-2-3-6-17(15)28-21(18)24-19/h4,7-11H,2-3,5-6,12H2,1H3,(H,23,24,26)
InChIKey NARQLVWQIOHFKD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31172
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1737967; SBI_ID: SBI-031176
Temperature 308 °C