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Dimethyl 3,4-dioxo-2,5-bis(triphenylphosphoranylidene)hexane-1,6-dioate
SpectraBase Compound ID EPzZ8J7SyfP
InChI InChI=1S/C44H36O6P2/c1-49-43(47)41(51(33-21-9-3-10-22-33,34-23-11-4-12-24-34)35-25-13-5-14-26-35)39(45)40(46)42(44(48)50-2)52(36-27-15-6-16-28-36,37-29-17-7-18-30-37)38-31-19-8-20-32-38/h3-32H,1-2H3
InChIKey VXDGVSUTHQYBCF-UHFFFAOYSA-N
Mol Weight 722.7 g/mol
Molecular Formula C44H36O6P2
Exact Mass 722.198713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiVBAfTyWCA
Name Dimethyl 3,4-dioxo-2,5-bis(triphenylphosphoranylidene)hexane-1,6-dioate
Alternate Name(s) 3,4-Diketo-2,5-bis(triphenylphosphoranylidene)adipic acid dimethyl ester 3,4-Dioxo-2,5-bis(triphenylphosphoranylidene)hexanedioic acid dimethyl ester Dimethyl 3,4-bis(oxidanylidene)-2,5-bis(triphenyl-phosphanylidene)hexanedioate Dimethyl 3,4-dioxo-2,5-bis(triphenyl-phosphanylidene)hexanedioate Dimethyl 3,4-dioxo-2,5-bis(triphenylphosphoranylidene)hexanedioate Dimethyl 3,4-dioxo-2,5-bis(triphenyl-$l^{5}-phosphanylidene)hexanedioate
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Formula C44H36O6P2
InChI InChI=1S/C44H36O6P2/c1-49-43(47)41(51(33-21-9-3-10-22-33,34-23-11-4-12-24-34)35-25-13-5-14-26-35)39(45)40(46)42(44(48)50-2)52(36-27-15-6-16-28-36,37-29-17-7-18-30-37)38-31-19-8-20-32-38/h3-32H,1-2H3
InChIKey VXDGVSUTHQYBCF-UHFFFAOYSA-N
Molecular Weight 722.714 g/mol
SMILES C(C(C(C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC)=O)=O)(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC
SPLASH splash10-03di-0092000000-c7d117bb24fea6fc2ec4
Source of Spectrum KC-0-489-6
Wiley ID 785178