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Bis(5-methoxycarbonyl-2-methyl-6-methylthio-4-pyrimidyl)disulfide
SpectraBase Compound ID 9C7PAOuUsYm
InChI InChI=1S/C16H18N4O4S4/c1-7-17-11(25-5)9(15(21)23-3)13(19-7)27-28-14-10(16(22)24-4)12(26-6)18-8(2)20-14/h1-6H3
InChIKey YUFPDIULAANGGV-UHFFFAOYSA-N
Mol Weight 458.6 g/mol
Molecular Formula C16H18N4O4S4
Exact Mass 458.02109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NeoCC7TLJ9
Name Bis(5-methoxycarbonyl-2-methyl-6-methylthio-4-pyrimidyl)disulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N4O4S4
InChI InChI=1S/C16H18N4O4S4/c1-7-17-11(25-5)9(15(21)23-3)13(19-7)27-28-14-10(16(22)24-4)12(26-6)18-8(2)20-14/h1-6H3
InChIKey YUFPDIULAANGGV-UHFFFAOYSA-N
Molecular Weight 458.584 g/mol
SMILES c1(c(c(SC)nc(n1)C)C(=O)OC)SSc1c(c(SC)nc(n1)C)C(=O)OC
SPLASH splash10-01ta-5970100000-f0ba8d4a6144674e4906
Source of Spectrum H1-34-1578-3
Synonyms Methyl 4-{[5-(methoxycarbonyl)-2-methyl-6-(methylsulfanyl)-4-pyrimidinyl]disulfanyl}-2-methyl-6-(methylsulfanyl)-5-pyrimidinecarboxylate
Wiley ID 754755