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4(1H)-Pyrimidinone, 2-(ethylthio)-5-fluoro-1-(phenylmethyl)-
SpectraBase Compound ID L6CmOHy1NC4
InChI InChI=1S/C13H13FN2OS/c1-2-18-13-15-12(17)11(14)9-16(13)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey ULBHJKRROAZQBD-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C13H13FN2OS
Exact Mass 264.073262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoIZ6vxIvSZ
Name 4(1H)-Pyrimidinone, 2-(ethylthio)-5-fluoro-1-(phenylmethyl)-
Alternate Name(s) 1-Benzyl-2-(ethylsulfanyl)-5-fluoro-4(1H)-pyrimidinone 1-Benzyl-2-ethylthio-5-fluoropyrimidin-4-one
CAS Registry Number 81560-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13FN2OS
InChI InChI=1S/C13H13FN2OS/c1-2-18-13-15-12(17)11(14)9-16(13)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey ULBHJKRROAZQBD-UHFFFAOYSA-N
Molecular Weight 264.318 g/mol
SMILES C1(=NC(C(=CN1Cc1ccccc1)F)=O)SCC
SPLASH splash10-0006-9130000000-db8e641190deb4139393
Source of Spectrum SB-36-17-0
Wiley ID 1267655