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Tetrakis[4-(10-methylphenothiazine-3-yl)phenylen-1-yl]methane
SpectraBase Compound ID IkcuNUOQiZ5
InChI InChI=1S/C77H56N4S4/c1-78-61-13-5-9-17-69(61)82-73-45-53(29-41-65(73)78)49-21-33-57(34-22-49)77(58-35-23-50(24-36-58)54-30-42-66-74(46-54)83-70-18-10-6-14-62(70)79(66)2,59-37-25-51(26-38-59)55-31-43-67-75(47-55)84-71-19-11-7-15-63(71)80(67)3)60-39-27-52(28-40-60)56-32-44-68-76(48-56)85-72-20-12-8-16-64(72)81(68)4/h5-48H,1-4H3
InChIKey JHJSPFUUDMNAIO-UHFFFAOYSA-N
Mol Weight 1165.6 g/mol
Molecular Formula C77H56N4S4
Exact Mass 1164.338783 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYVBMdBBqhE
Name Tetrakis[4-(10-methylphenothiazine-3-yl)phenylen-1-yl]methane
Alternate Name(s) Tetrakis[4-(10-methylphenothiazin-3-yl)phenylen-1-yl]methane
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Formula C77H56N4S4
InChI InChI=1S/C77H56N4S4/c1-78-61-13-5-9-17-69(61)82-73-45-53(29-41-65(73)78)49-21-33-57(34-22-49)77(58-35-23-50(24-36-58)54-30-42-66-74(46-54)83-70-18-10-6-14-62(70)79(66)2,59-37-25-51(26-38-59)55-31-43-67-75(47-55)84-71-19-11-7-15-63(71)80(67)3)60-39-27-52(28-40-60)56-32-44-68-76(48-56)85-72-20-12-8-16-64(72)81(68)4/h5-48H,1-4H3
InChIKey JHJSPFUUDMNAIO-UHFFFAOYSA-N
Molecular Weight 1165.563 g/mol
SMILES c12N(c3c(Sc2cc(cc1)-c1ccc(C(c2ccc(-c4cc5Sc6ccccc6N(c5cc4)C)cc2)(c2ccc(-c4cc5Sc6ccccc6N(c5cc4)C)cc2)c2ccc(-c4cc5Sc6ccccc6N(c5cc4)C)cc2)cc1)cccc3)C
SPLASH splash10-00lr-3900000000-de4f3bd7022e814c4a55
Source of Spectrum C5-2002-1169-11
Wiley ID 1614684