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4,7-Di(para-ethoxyphenyl)-6-(3,4-dimethoxyphenyl)-1,2,5-thiadiazolo(3,4-c)pyridine
SpectraBase Compound ID IcLe054Fq1d
InChI InChI=1S/C29H27N3O4S/c1-5-35-21-12-7-18(8-13-21)25-26(20-11-16-23(33-3)24(17-20)34-4)30-27(29-28(25)31-37-32-29)19-9-14-22(15-10-19)36-6-2/h7-17H,5-6H2,1-4H3
InChIKey YAXQHBVMXXPLPS-UHFFFAOYSA-N
Mol Weight 513.61 g/mol
Molecular Formula C29H27N3O4S
Exact Mass 513.172228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEf1a4oSxk3
Name 4,7-Di(para-ethoxyphenyl)-6-(3,4-dimethoxyphenyl)-1,2,5-thiadiazolo(3,4-c)pyridine
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Formula C29H27N3O4S
InChI InChI=1S/C29H27N3O4S/c1-5-35-21-12-7-18(8-13-21)25-26(20-11-16-23(33-3)24(17-20)34-4)30-27(29-28(25)31-37-32-29)19-9-14-22(15-10-19)36-6-2/h7-17H,5-6H2,1-4H3
InChIKey YAXQHBVMXXPLPS-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 513.612 g/mol
SMILES c1(nc(c2c(c1-c1ccc(cc1)OCC)nsn2)-c1ccc(cc1)OCC)-c1ccc(c(c1)OC)OC
SPLASH splash10-03di-1000790000-dfb08cc1c1aee034072c
Source of Spectrum SRH-2022-11537-0
Wiley ID 1833119