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6-(benzylthio)-1H-pyrimidin-2-one
SpectraBase Compound ID 5S1GdRMqSm0
InChI InChI=1S/C11H10N2OS/c14-11-12-7-6-10(13-11)15-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13,14)
InChIKey VWIIEGVFHWRXEZ-UHFFFAOYSA-N
Mol Weight 218.27 g/mol
Molecular Formula C11H10N2OS
Exact Mass 218.051384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rODj9w6pk
Name 6-(benzylthio)-1H-pyrimidin-2-one
Alternate Name(s) 6-(Phenylmethylsulfanyl)-1H-pyrimidin-2-one 6-(Phenylmethylthio)-1H-pyrimidin-2-one 6-Benzylsulfanyl-1H-pyrimidin-2-one
CAS Registry Number 78932-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2OS
InChI InChI=1S/C11H10N2OS/c14-11-12-7-6-10(13-11)15-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13,14)
InChIKey VWIIEGVFHWRXEZ-UHFFFAOYSA-N
Molecular Weight 218.274 g/mol
SMILES N1C=CC(=NC1=O)SCc1ccccc1
SPLASH splash10-014l-9580000000-9b47e3077683a844bbcf
Source of Spectrum 0-16-155-3
Wiley ID 1217287