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Methyl 6-(4-{11-[4-(5-methoxyglutaryl)phenyl]undecyl}phenyl)-6-oxohexanoate
SpectraBase Compound ID IXHVoH7BIpd
InChI InChI=1S/C36H50O6/c1-41-35(39)19-13-12-17-33(37)31-25-21-29(22-26-31)15-10-8-6-4-3-5-7-9-11-16-30-23-27-32(28-24-30)34(38)18-14-20-36(40)42-2/h21-28H,3-20H2,1-2H3
InChIKey QQFXLNFKMFUIRR-UHFFFAOYSA-N
Mol Weight 578.8 g/mol
Molecular Formula C36H50O6
Exact Mass 578.360739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxpvAEq4VHZ
Name Methyl 6-(4-{11-[4-(5-methoxyglutaryl)phenyl]undecyl}phenyl)-6-oxohexanoate
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Formula C36H50O6
InChI InChI=1S/C36H50O6/c1-41-35(39)19-13-12-17-33(37)31-25-21-29(22-26-31)15-10-8-6-4-3-5-7-9-11-16-30-23-27-32(28-24-30)34(38)18-14-20-36(40)42-2/h21-28H,3-20H2,1-2H3
InChIKey QQFXLNFKMFUIRR-UHFFFAOYSA-N
Molecular Weight 578.790 g/mol
SMILES C(=O)(OC)CCCC(c1ccc(cc1)CCCCCCCCCCCc1ccc(C(=O)CCCCC(=O)OC)cc1)=O
SPLASH splash10-001i-4900220000-7a0f397a3065aad3a6f0
Source of Spectrum KC-0-1148-37
Synonyms Methyl 5-(4-{11-[4-(5-methoxy-5-oxopentanoyl)phenyl]undecyl}phenyl)-4-methyl-5-oxopentanoate 6-[4-[11-[4-(5-methoxy-1,5-dioxopentyl)phenyl]undecyl]phenyl]-6-oxohexanoic acid methyl ester Methyl 6-[4-[11-[4-(5-methoxy-5-oxopentanoyl)phenyl]undecyl]phenyl]-6-oxohexanoate Methyl 6-[4-[11-[4-(5-methoxy-5-oxo-pentanoyl)phenyl]undecyl]phenyl]-6-oxo-hexanoate Methyl 6-[4-[11-[4-(5-methoxy-5-oxidanylidene-pentanoyl)phenyl]undecyl]phenyl]-6-oxidanylidene-hexanoate
Wiley ID 785642