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5-[8-(3,5-dicarbomethoxyphenyl)octyl]benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID LkxjfKHTx1W
InChI InChI=1S/C28H34O8/c1-33-25(29)21-13-19(14-22(17-21)26(30)34-2)11-9-7-5-6-8-10-12-20-15-23(27(31)35-3)18-24(16-20)28(32)36-4/h13-18H,5-12H2,1-4H3
InChIKey HVGYFZBKIVMZJO-UHFFFAOYSA-N
Mol Weight 498.6 g/mol
Molecular Formula C28H34O8
Exact Mass 498.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8xr6QLpDfD
Name 5-[8-(3,5-dicarbomethoxyphenyl)octyl]benzene-1,3-dicarboxylic acid dimethyl ester
Alternate Name(s) 5-[8-[3,5-bis(methoxycarbonyl)phenyl]octyl]benzene-1,3-dicarboxylic acid dimethyl ester dimethyl 5-[8-[3,5-bis(methoxycarbonyl)phenyl]octyl]benzene-1,3-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C28H34O8
InChI InChI=1S/C28H34O8/c1-33-25(29)21-13-19(14-22(17-21)26(30)34-2)11-9-7-5-6-8-10-12-20-15-23(27(31)35-3)18-24(16-20)28(32)36-4/h13-18H,5-12H2,1-4H3
InChIKey HVGYFZBKIVMZJO-UHFFFAOYSA-N
Molecular Weight 498.572 g/mol
SMILES C(CCCCCCCc1cc(cc(c1)C(=O)OC)C(=O)OC)c1cc(cc(c1)C(=O)OC)C(=O)OC
SPLASH splash10-000i-0900000000-f085974dcc234c615553
Source of Spectrum J-65-5368-16
Wiley ID 1532981