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2-{amino[4-amino-6-(3,4-dimethoxyphenyl)-3-oxatricyclo[8.4.0.0(2,7)]tetradeca-1(10),2(7),4,8,11,13-hexaen-5-yl]methylidene}propanedinitrile
SpectraBase Compound ID 3lE2ogyzVnD
InChI InChI=1S/C25H20N4O3/c1-30-19-10-8-15(11-20(19)31-2)21-18-9-7-14-5-3-4-6-17(14)24(18)32-25(29)22(21)23(28)16(12-26)13-27/h3-11,21H,28-29H2,1-2H3
InChIKey KCWMSVFVVPVAMM-UHFFFAOYSA-N
Mol Weight 424.46 g/mol
Molecular Formula C25H20N4O3
Exact Mass 424.153541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RGJ3iMag7A
Name 2-{amino[4-amino-6-(3,4-dimethoxyphenyl)-3-oxatricyclo[8.4.0.0(2,7)]tetradeca-1(10),2(7),4,8,11,13-hexaen-5-yl]methylidene}propanedinitrile
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Formula C25H20N4O3
InChI InChI=1S/C25H20N4O3/c1-30-19-10-8-15(11-20(19)31-2)21-18-9-7-14-5-3-4-6-17(14)24(18)32-25(29)22(21)23(28)16(12-26)13-27/h3-11,21H,28-29H2,1-2H3
InChIKey KCWMSVFVVPVAMM-UHFFFAOYSA-N
Molecular Weight 424.460 g/mol
SMILES NC1=C(C(=C(C#N)C#N)N)C(c2c(O1)c1c(cc2)cccc1)c1cc(c(OC)cc1)OC
SPLASH splash10-000i-5490000000-f2cfb63a95d1eec224eb
Source of Spectrum IY-2-4971-6
Synonyms Propanedinitrile, 2-[amino[2-amino-4-(3,4-dimethoxyphenyl)-4H-naphtho[1,2-b]pyran-3-yl]methylene]- 2-[amino-[2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h][1]benzopyran-3-yl]methylidene]propanedinitrile 2-[amino-[2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromen-3-yl]methylidene]propanedinitrile 2-[amino-[2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromen-3-yl]methylene]propanedinitrile 2-[azanyl-[2-azanyl-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromen-3-yl]methylidene]propanedinitrile
Wiley ID 1657699