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1-[4-(3-Hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl]-3-phenylprop-2-en-1-one
SpectraBase Compound ID 9A482rfWsTx
InChI InChI=1S/C20H18N2O2S/c1-13-18(17(24)11-10-14-6-3-2-4-7-14)19(22-20(25)21-13)15-8-5-9-16(23)12-15/h2-12,19,23H,1H3,(H2,21,22,25)
InChIKey CTOHQZXLCAKZME-UHFFFAOYSA-N
Mol Weight 350.44 g/mol
Molecular Formula C20H18N2O2S
Exact Mass 350.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RES9LWE18w
Name 1-[4-(3-Hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl]-3-phenylprop-2-en-1-one
Appearance Brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O2S
InChI InChI=1S/C20H18N2O2S/c1-13-18(17(24)11-10-14-6-3-2-4-7-14)19(22-20(25)21-13)15-8-5-9-16(23)12-15/h2-12,19,23H,1H3,(H2,21,22,25)
InChIKey CTOHQZXLCAKZME-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4350
Molecular Weight 350.436 g/mol
SMILES N1C(NC(=C(C1c1cc(ccc1)O)C(C=Cc1ccccc1)=O)C)=S
SPLASH splash10-0bvi-9100000000-2c2b7e1b39adc9086d28
Source of Spectrum Y-58-2266-4
Wiley ID 1879343