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7-(2-(3-oxooctyl)-3,5-di(acetoxy)cyclopenyl)-5(Z)-heptenoic acid methyl ester
SpectraBase Compound ID 4EsPRvahzPw
InChI InChI=1S/C25H40O7/c1-5-6-9-12-20(28)15-16-22-21(13-10-7-8-11-14-25(29)30-4)23(31-18(2)26)17-24(22)32-19(3)27/h7,10,21-24H,5-6,8-9,11-17H2,1-4H3/b10-7+
InChIKey IWJUDTHCHNQBQX-JXMROGBWSA-N
Mol Weight 452.6 g/mol
Molecular Formula C25H40O7
Exact Mass 452.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhrfjhaMdcB
Name 7-(2-(3-oxooctyl)-3,5-di(acetoxy)cyclopenyl)-5(Z)-heptenoic acid methyl ester
Alternate Name(s) (5E)-11-(acetyloxy)-1-methoxy-1,15-dioxoprost-5-en-9-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O7
InChI InChI=1S/C25H40O7/c1-5-6-9-12-20(28)15-16-22-21(13-10-7-8-11-14-25(29)30-4)23(31-18(2)26)17-24(22)32-19(3)27/h7,10,21-24H,5-6,8-9,11-17H2,1-4H3/b10-7+
InChIKey IWJUDTHCHNQBQX-JXMROGBWSA-N
Molecular Weight 452.588 g/mol
SMILES C1(C(C(C\C=C\CCCC(=O)OC)C(C1)OC(=O)C)CCC(=O)CCCCC)OC(=O)C
SPLASH splash10-00lr-2693000000-dd8cb2c06d6b934d29eb
Source of Spectrum B3-0-458-1
Wiley ID 1388278