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4,4''-Di(methoxycarbonyl)-p-quaterphenylene
SpectraBase Compound ID LPb8AFuNsAv
InChI InChI=1S/C28H22O4/c1-31-27(29)25-15-11-23(12-16-25)21-7-3-19(4-8-21)20-5-9-22(10-6-20)24-13-17-26(18-14-24)28(30)32-2/h3-18H,1-2H3
InChIKey FKWQQNXEBORFRT-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C28H22O4
Exact Mass 422.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVejaLozTAJ
Name 4,4''-Di(methoxycarbonyl)-p-quaterphenylene
Alternate Name(s) [1,1';4',1'';4'',1''']Quaterphenyl-4,4'''-dicarboxylic acid dimethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C28H22O4
InChI InChI=1S/C28H22O4/c1-31-27(29)25-15-11-23(12-16-25)21-7-3-19(4-8-21)20-5-9-22(10-6-20)24-13-17-26(18-14-24)28(30)32-2/h3-18H,1-2H3
InChIKey FKWQQNXEBORFRT-UHFFFAOYSA-N
Molecular Weight 422.480 g/mol
SMILES C(c1ccc(-c2ccc(-c3ccc(-c4ccc(C(=O)OC)cc4)cc3)cc2)cc1)(=O)OC
SPLASH splash10-00di-0000900000-d50790ec2221a343458d
Source of Spectrum F-67-2560-7f
Wiley ID 1686128