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5-(2-(3-(acetoxy)-1-octenyl)-3,5-di(acetoxy)-cyclopentyl)pentanoic acid methyl ester
SpectraBase Compound ID LPiNj2aLc4Y
InChI InChI=1S/C25H40O8/c1-6-7-8-11-20(31-17(2)26)14-15-22-21(12-9-10-13-25(29)30-5)23(32-18(3)27)16-24(22)33-19(4)28/h14-15,20-24H,6-13,16H2,1-5H3/b15-14+
InChIKey DPRQUWWMOLFGPJ-CCEZHUSRSA-N
Mol Weight 468.6 g/mol
Molecular Formula C25H40O8
Exact Mass 468.272318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61DtRwjC4Ka
Name 5-(2-(3-(acetoxy)-1-octenyl)-3,5-di(acetoxy)-cyclopentyl)pentanoic acid methyl ester
Alternate Name(s) Methyl 5-{3,5-bis(acetyloxy)-2-[(1E)-3-(acetyloxy)-1-octenyl]cyclopentyl}pentanoate
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Formula C25H40O8
InChI InChI=1S/C25H40O8/c1-6-7-8-11-20(31-17(2)26)14-15-22-21(12-9-10-13-25(29)30-5)23(32-18(3)27)16-24(22)33-19(4)28/h14-15,20-24H,6-13,16H2,1-5H3/b15-14+
InChIKey DPRQUWWMOLFGPJ-CCEZHUSRSA-N
Molecular Weight 468.587 g/mol
SMILES C1(C(\C=C\C(OC(=O)C)CCCCC)C(CCCCC(=O)OC)C(C1)OC(=O)C)OC(=O)C
SPLASH splash10-052r-0496000000-7cbe8e4584da920d5c3f
Source of Spectrum B3-0-422-2
Wiley ID 1392387