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DIMETHYL-4,4'-[OCTANE-1,8-DIYLDI-(PARA-PHENYLENE)]-DIBUTANOATE
SpectraBase Compound ID FxHOVt8GcZ0
InChI InChI=1S/C30H42O4/c1-33-29(31)15-9-13-27-21-17-25(18-22-27)11-7-5-3-4-6-8-12-26-19-23-28(24-20-26)14-10-16-30(32)34-2/h17-24H,3-16H2,1-2H3
InChIKey TXMOPVVPAHHEFF-UHFFFAOYSA-N
Mol Weight 466.7 g/mol
Molecular Formula C30H42O4
Exact Mass 466.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMA6anAjOK5
Name Dimethyl 4,4'-[octane-1,8-diyldi(p-phenylene)]dibutanoate
Alternate Name(s) Methyl 4-(4-{8-[4-(4-methoxy-4-oxobutyl)phenyl]octyl}phenyl)butanoate 4-[4-[8-[4-(4-methoxy-4-oxobutyl)phenyl]octyl]phenyl]butanoic acid methyl ester Methyl 4-[4-[8-[4-(4-methoxy-4-oxobutyl)phenyl]octyl]phenyl]butanoate Methyl 4-[4-[8-[4-(4-methoxy-4-oxo-butyl)phenyl]octyl]phenyl]butanoate Methyl 4-[4-[8-[4-(4-methoxy-4-oxidanylidene-butyl)phenyl]octyl]phenyl]butanoate
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Formula C30H42O4
InChI InChI=1S/C30H42O4/c1-33-29(31)15-9-13-27-21-17-25(18-22-27)11-7-5-3-4-6-8-12-26-19-23-28(24-20-26)14-10-16-30(32)34-2/h17-24H,3-16H2,1-2H3
InChIKey TXMOPVVPAHHEFF-UHFFFAOYSA-N
Molecular Weight 466.662 g/mol
SMILES C(=O)(OC)CCCc1ccc(cc1)CCCCCCCCc1ccc(cc1)CCCC(=O)OC
SPLASH splash10-014i-0902100000-b5db95a0f3713ed6c9fc
Source of Spectrum KC-0-1145-13
Wiley ID 785661