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6,7-Dimethoxy-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one

View entire compound with spectra: 2 NMR, and 1 MS (GC)

6,7-Dimethoxy-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one
SpectraBase Compound ID 1M38Z4taXvy
InChI InChI=1S/C16H14N2O3S/c1-20-13-8-11-12(9-14(13)21-2)17-16(22)18(15(11)19)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,22)
InChIKey DKEYZNUDLQFDAL-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C16H14N2O3S
Exact Mass 314.072513 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KhbsMMXkbSA
Name 4(3H)-quinazolinone, 2-mercapto-6,7-dimethoxy-3-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.072513490 u
Formula C16H14N2O3S
InChI InChI=1S/C16H14N2O3S/c1-20-13-8-11-12(9-14(13)21-2)17-16(22)18(15(11)19)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,22)
InChIKey DKEYZNUDLQFDAL-UHFFFAOYSA-N
Molecular Weight 314.359 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13197
Solvent DMSO-d6
Source Vendor ID: NMR/10301305; Lab Info: LP; Lab Number: LP-2101385