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2,7-Di(di-n-butylamino)-3,6-diphenylthieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
SpectraBase Compound ID L7vWKTAZvxv
InChI InChI=1S/C36H46N6O2S/c1-5-9-23-39(24-10-6-2)35-37-31-29(33(43)41(35)27-19-15-13-16-20-27)30-32(45-31)38-36(40(25-11-7-3)26-12-8-4)42(34(30)44)28-21-17-14-18-22-28/h13-22H,5-12,23-26H2,1-4H3
InChIKey TVCLDJLJBKSNRI-UHFFFAOYSA-N
Mol Weight 626.9 g/mol
Molecular Formula C36H46N6O2S
Exact Mass 626.340296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TfdIfK89hn
Name 2,7-Di(di-n-butylamino)-3,6-diphenylthieno[2,3-d:5,4-d']dipyrimidine-4,5(3H,6H)-dione
Alternate Name(s) 2,7-bis(dibutylamino)-3,6-diphenyl-3,6-dihydropyrimido[5',4':4,5]thieno[2,3-d]pyrimidine-4,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H46N6O2S
InChI InChI=1S/C36H46N6O2S/c1-5-9-23-39(24-10-6-2)35-37-31-29(33(43)41(35)27-19-15-13-16-20-27)30-32(45-31)38-36(40(25-11-7-3)26-12-8-4)42(34(30)44)28-21-17-14-18-22-28/h13-22H,5-12,23-26H2,1-4H3
InChIKey TVCLDJLJBKSNRI-UHFFFAOYSA-N
Molecular Weight 626.864 g/mol
SMILES c12c3c(N=C(N(C3=O)c3ccccc3)N(CCCC)CCCC)sc1N=C(N(C2=O)c1ccccc1)N(CCCC)CCCC
SPLASH splash10-05r0-7523009000-7ea8d8e4382cef08550a
Source of Spectrum F-69-8369-6
Wiley ID 1595893