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2,8-Bis(dimethylamino)-4,6-diethoxy-5-(4-nitrophenyl)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
SpectraBase Compound ID AQU00v7iOom
InChI InChI=1S/C23H27N7O4S/c1-7-33-18-16-15(13-9-11-14(12-10-13)30(31)32)17-19(34-8-2)25-23(29(5)6)27-21(17)35-20(16)26-22(24-18)28(3)4/h9-12,15H,7-8H2,1-6H3
InChIKey FULXCQVSMJNJEC-UHFFFAOYSA-N
Mol Weight 497.57 g/mol
Molecular Formula C23H27N7O4S
Exact Mass 497.184524 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtFRTG1sfmh
Name 2,8-Bis(dimethylamino)-4,6-diethoxy-5-(4-nitrophenyl)-5H-thiopyrano[2,3-d:6,5-d']dipyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C23H27N7O4S
InChI InChI=1S/C23H27N7O4S/c1-7-33-18-16-15(13-9-11-14(12-10-13)30(31)32)17-19(34-8-2)25-23(29(5)6)27-21(17)35-20(16)26-22(24-18)28(3)4/h9-12,15H,7-8H2,1-6H3
InChIKey FULXCQVSMJNJEC-UHFFFAOYSA-N
Molecular Weight 497.574 g/mol
SMILES c12nc(N(C)C)nc(c2C(c2ccc([N+]([O-])=O)cc2)c2c(S1)nc(N(C)C)nc2OCC)OCC
SPLASH splash10-004i-0009100000-85564e9695608dff5243
Source of Spectrum H1-52-343-6c
Wiley ID 817565