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5-(4-Methoxyphenyl)-6,8-dithioxo-6,7,8,9-tetrahydropyrido[2,3-d:6,5-d??]dipyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 7LJOFnzoBh
InChI InChI=1S/C16H11N5O3S2/c1-24-7-4-2-6(3-5-7)8-9-11(18-15(23)20-13(9)22)17-12-10(8)14(25)21-16(26)19-12/h2-5H,1H3,(H4,17,18,19,20,21,22,23,25,26)
InChIKey SXAJQIJQYUEYGK-UHFFFAOYSA-N
Mol Weight 385.42 g/mol
Molecular Formula C16H11N5O3S2
Exact Mass 385.030332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfC5sM0tWzE
Name 5-(4-Methoxyphenyl)-6,8-dithioxo-6,7,8,9-tetrahydropyrido[2,3-d:6,5-d??]dipyrimidine-2,4(1H,3H)-dione
Appearance Yellow
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N5O3S2
InChI InChI=1S/C16H11N5O3S2/c1-24-7-4-2-6(3-5-7)8-9-11(18-15(23)20-13(9)22)17-12-10(8)14(25)21-16(26)19-12/h2-5H,1H3,(H4,17,18,19,20,21,22,23,25,26)
InChIKey SXAJQIJQYUEYGK-UHFFFAOYSA-N
Instrument Name Schimadzu-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4109
Molecular Weight 385.416 g/mol
SMILES N1C(c2c(c3C(NC(Nc3nc2NC1=O)=S)=S)-c1ccc(cc1)OC)=O
SPLASH splash10-004r-4900000000-ebd3ab531775f894e95c
Source of Spectrum Y-57-4003-10
Wiley ID 1859886