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Uracil, 3-(2-mercaptoethyl)-6-phenyl-
SpectraBase Compound ID HGYwrXLa8OC
InChI InChI=1S/C12H12N2O2S/c15-11-8-10(9-4-2-1-3-5-9)13-12(16)14(11)6-7-17/h1-5,8,17H,6-7H2,(H,13,16)
InChIKey CZMXKJINTZUCAJ-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C12H12N2O2S
Exact Mass 248.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkvXP0Uk3Za
Name Uracil, 3-(2-mercaptoethyl)-6-phenyl-
CAS Registry Number 29558-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O2S
InChI InChI=1S/C12H12N2O2S/c15-11-8-10(9-4-2-1-3-5-9)13-12(16)14(11)6-7-17/h1-5,8,17H,6-7H2,(H,13,16)
InChIKey CZMXKJINTZUCAJ-UHFFFAOYSA-N
Molecular Weight 248.300 g/mol
SMILES SCCN1C(C=C(c2ccccc2)NC1=O)=O
SPLASH splash10-000i-6900000000-1f7ba6755ea812d08688
Source of Spectrum S-24-1427-3
Synonyms 6-Phenyl-3-(2-sulfanylethyl)-2,4(1H,3H)-pyrimidinedione 3-(2-mercaptoethyl)-6-phenyl-1H-pyrimidine-2,4-dione 3-(2-mercaptoethyl)-6-phenyl-uracil 6-Phenyl-3-(2-sulfanylethyl)-1H-pyrimidine-2,4-dione
Wiley ID 1250730