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1,1'-Bis-[4-(methylamino)anthraquinonyl]sulphide
SpectraBase Compound ID CJAi3uPxegD
InChI InChI=1S/C30H20N2O4S/c1-31-19-11-13-21(25-23(19)27(33)15-7-3-5-9-17(15)29(25)35)37-22-14-12-20(32-2)24-26(22)30(36)18-10-6-4-8-16(18)28(24)34/h3-14,31-32H,1-2H3
InChIKey YWXBDACBNBLHMN-UHFFFAOYSA-N
Mol Weight 504.56 g/mol
Molecular Formula C30H20N2O4S
Exact Mass 504.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENzBdrvn1dt
Name 1,1'-Bis-[4-(methylamino)anthraquinonyl]sulphide
Alternate Name(s) 1-(methylamino)-4-{[4-(methylamino)-9,10-dioxo-9,10-dihydro-1-anthracenyl]sulfanyl}anthra-9,10-quinone
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Formula C30H20N2O4S
InChI InChI=1S/C30H20N2O4S/c1-31-19-11-13-21(25-23(19)27(33)15-7-3-5-9-17(15)29(25)35)37-22-14-12-20(32-2)24-26(22)30(36)18-10-6-4-8-16(18)28(24)34/h3-14,31-32H,1-2H3
InChIKey YWXBDACBNBLHMN-UHFFFAOYSA-N
Molecular Weight 504.560 g/mol
SMILES N(c1c2c(c(Sc3ccc(c4c3C(c3c(C4=O)cccc3)=O)NC)cc1)C(c1c(C2=O)cccc1)=O)C
SPLASH splash10-014i-0190010000-bc34e456a434597b7c02
Source of Spectrum IC-1234-0-0
Wiley ID 1399608