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

*Links on SpectraBase are not permalinks.
5-Benzoyl-3-methyl-2-(methylthio)pyrimidin-4(3H)-one
SpectraBase Compound ID CPvoT5w3C6o
InChI InChI=1S/C13H12N2O2S/c1-15-12(17)10(8-14-13(15)18-2)11(16)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey SZRAOKYJYFIANM-UHFFFAOYSA-N
Mol Weight 260.31 g/mol
Molecular Formula C13H12N2O2S
Exact Mass 260.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID krUf5Va3HO
Name 5-Benzoyl-3-methyl-2-(methylthio)pyrimidin-4(3H)-one
Appearance Orange crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2S
InChI InChI=1S/C13H12N2O2S/c1-15-12(17)10(8-14-13(15)18-2)11(16)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey SZRAOKYJYFIANM-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000879
Molecular Weight 260.311 g/mol
SMILES CN1C(SC)=NC=C(C(=O)c2ccccc2)C1=O
SPLASH splash10-0bu1-0390000000-3b5c94783251657c0f26
Source of Spectrum U1-2020-5534-4a
Wiley ID 1860920