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Diethyl 2-methyl-6-(pyrimidin-2-ylthio)-4-thioxo-5,6-dihydro-4H-1,3-oxazine-5,6-dicarboxylate
SpectraBase Compound ID 4HJceoSuSG4
InChI InChI=1S/C15H17N3O5S2/c1-4-21-12(19)10-11(24)18-9(3)23-15(10,13(20)22-5-2)25-14-16-7-6-8-17-14/h6-8,10H,4-5H2,1-3H3
InChIKey VHGXLKXAOUBDEE-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C15H17N3O5S2
Exact Mass 383.060963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLerHTg742y
Name Diethyl 2-methyl-6-(pyrimidin-2-ylthio)-4-thioxo-5,6-dihydro-4H-1,3-oxazine-5,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17N3O5S2
InChI InChI=1S/C15H17N3O5S2/c1-4-21-12(19)10-11(24)18-9(3)23-15(10,13(20)22-5-2)25-14-16-7-6-8-17-14/h6-8,10H,4-5H2,1-3H3
InChIKey VHGXLKXAOUBDEE-UHFFFAOYSA-N
Molecular Weight 383.437 g/mol
SMILES C1(C(C(=S)N=C(O1)C)C(=O)OCC)(Sc1ncccn1)C(=O)OCC
SPLASH splash10-014i-0394000000-3577ad1a1db130d15ec5
Source of Spectrum Y-50-1393-5a
Synonyms 2-Methyl-6-(2-pyrimidinylthio)-4-sulfanylidene-5H-1,3-oxazine-5,6-dicarboxylic acid diethyl ester Diethyl 2-methyl-6-pyrimidin-2-ylsulfanyl-4-thioxo-5H-1,3-oxazine-5,6-dicarboxylate Diethyl 2-methyl-6-pyrimidin-2-ylsulfanyl-4-sulfanylidene-5H-1,3-oxazine-5,6-dicarboxylate
Wiley ID 1741149