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Methyl 9-[3'-ethoxycarbonyl-2'-phenyl-5'-furyl)-3,7-dimethyl-2,4,6,8-nonateraenoate

View entire compound with spectra: 1 MS (GC)

Methyl 9-[3'-ethoxycarbonyl-2'-phenyl-5'-furyl)-3,7-dimethyl-2,4,6,8-nonateraenoate
SpectraBase Compound ID 3Fei50Xc1mI
InChI InChI=1S/C25H26O5/c1-5-29-25(27)22-17-21(30-24(22)20-12-7-6-8-13-20)15-14-18(2)10-9-11-19(3)16-23(26)28-4/h6-17H,5H2,1-4H3/b11-9+,15-14+,18-10+,19-16+
InChIKey QPMFWMKJSQWTDQ-IGCXYQEGSA-N
Mol Weight 406.48 g/mol
Molecular Formula C25H26O5
Exact Mass 406.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3k5dIMsOp2O
Name Methyl 9-[3'-ethoxycarbonyl-2'-phenyl-5'-furyl)-3,7-dimethyl-2,4,6,8-nonateraenoate
Alternate Name(s) Ethyl 5-[(1E,3E,5E,7E)-9-methoxy-3,7-dimethyl-9-oxo-1,3,5,7-nonatetraenyl]-2-phenyl-3-furoate Methyl 9-[3'-(ethoxycarbonyl)-2'-phenyl-5'-furyl)-3,7-dimethyl-nona-2,4,6,8-tetraen-1-oate
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Formula C25H26O5
InChI InChI=1S/C25H26O5/c1-5-29-25(27)22-17-21(30-24(22)20-12-7-6-8-13-20)15-14-18(2)10-9-11-19(3)16-23(26)28-4/h6-17H,5H2,1-4H3/b11-9+,15-14+,18-10+,19-16+
InChIKey QPMFWMKJSQWTDQ-IGCXYQEGSA-N
Molecular Weight 406.478 g/mol
SMILES c1(c(oc(c1)\C=C\C(=C\C=C\C(=C\C(=O)OC)C)C)-c1ccccc1)C(=O)OCC
SPLASH splash10-0a4i-1903200000-5afc8c794582e0586426
Source of Spectrum Y4-87-281-11
Wiley ID 1550254