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3-Amino-4-chloro-2'-(4-chlorophenoxy)-5'-trifluoromethylbenzanilide -> n,n'-(2-chloro-5-methyl-1,4-phenylene)-bis(acetoacetamide)
SpectraBase Compound ID BK8QUmlGV0S
InChI InChI=1S/C55H37Cl5F6N8O8/c1-26-20-41(68-53(80)49(28(3)76)74-72-43-22-30(5-17-38(43)59)51(78)70-45-24-32(55(64,65)66)7-19-47(45)82-36-14-10-34(57)11-15-36)39(60)25-40(26)67-52(79)48(27(2)75)73-71-42-21-29(4-16-37(42)58)50(77)69-44-23-31(54(61,62)63)6-18-46(44)81-35-12-8-33(56)9-13-35/h4-25,48-49H,1-3H3,(H,67,79)(H,68,80)(H,69,77)(H,70,78)/b73-71+,74-72+
InChIKey VOCMTGRPDQPZFA-SHIROVHISA-N
Mol Weight 1229.2 g/mol
Molecular Formula C55H37Cl5F6N8O8
Exact Mass 1226.108118 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID L7vRz3c0EeU
Name 3-Amino-4-chloro-2'-(4-chlorophenoxy)-5'-trifluoromethylbenzanilide -> n,n'-(2-chloro-5-methyl-1,4-phenylene)-bis(acetoacetamide)
Source of Sample Ciba-Geigy
Color Properties Colour Index Name= Pigment Yellow 128 Colour Index Number= 20037
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Formula C55H37Cl5F6N8O8
Hummel Decimal Number 012222
InChI InChI=1S/C55H37Cl5F6N8O8/c1-26-20-41(68-53(80)49(28(3)76)74-72-43-22-30(5-17-38(43)59)51(78)70-45-24-32(55(64,65)66)7-19-47(45)82-36-14-10-34(57)11-15-36)39(60)25-40(26)67-52(79)48(27(2)75)73-71-42-21-29(4-16-37(42)58)50(77)69-44-23-31(54(61,62)63)6-18-46(44)81-35-12-8-33(56)9-13-35/h4-25,48-49H,1-3H3,(H,67,79)(H,68,80)(H,69,77)(H,70,78)/b73-71+,74-72+
InChIKey VOCMTGRPDQPZFA-SHIROVHISA-N
Sample Description Yellow solid
Synonyms Cromophtal Gelb 8G
Technique KBr pellet