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2-Ethoxycarbonyl-3-(4,4-bis(4-chlorophenyl)-3-butenyl)-4,4-bis(4-chlorophenyl)-2-buten-4-olide
SpectraBase Compound ID Aj6DbvEw1eC
InChI InChI=1S/C35H26Cl4O4/c1-2-42-33(40)32-31(5-3-4-30(22-6-14-26(36)15-7-22)23-8-16-27(37)17-9-23)35(43-34(32)41,24-10-18-28(38)19-11-24)25-12-20-29(39)21-13-25/h4,6-21H,2-3,5H2,1H3
InChIKey JPPHETQRPJWNOY-UHFFFAOYSA-N
Mol Weight 652.4 g/mol
Molecular Formula C35H26Cl4O4
Exact Mass 650.05852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36nBlaNFITm
Name 2-Ethoxycarbonyl-3-(4,4-bis(4-chlorophenyl)-3-butenyl)-4,4-bis(4-chlorophenyl)-2-buten-4-olide
Alternate Name(s) 3-[4,4-Bis(4-chlorophenyl)-3-buteny]-4,4-bis(4-chlorophenyl)-2-ethoxycarbonyl-2-buten-4-olide Ethyl 4-[4,4-bis(4-chlorophenyl)-3-butenyl]-5,5-bis(4-chlorophenyl)-2-oxo-2,5-dihydro-3-furancarboxylate
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Formula C35H26Cl4O4
InChI InChI=1S/C35H26Cl4O4/c1-2-42-33(40)32-31(5-3-4-30(22-6-14-26(36)15-7-22)23-8-16-27(37)17-9-23)35(43-34(32)41,24-10-18-28(38)19-11-24)25-12-20-29(39)21-13-25/h4,6-21H,2-3,5H2,1H3
InChIKey JPPHETQRPJWNOY-UHFFFAOYSA-N
Molecular Weight 652.401 g/mol
SMILES C1(=C(C(c2ccc(cc2)Cl)(c2ccc(cc2)Cl)OC1=O)CCC=C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)C(=O)OCC
SPLASH splash10-0gw3-0133029000-9eca92707437018dc781
Source of Spectrum AJ-64-1106-11
Wiley ID 1413121