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5-[2-[(1E,3E)-5-methoxytrideca-1,3-dienyl]phenyl]pentaneperoxoic acid
5-[2-[(1E,3E)-5-methoxytrideca-1,3-dienyl]phenyl]pentaneperoxoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCCC(C=CC=CC1=CC=CC=C1CCCCC(=O)OO)OC
Isomeric SMILES
CCCCCCCCC(/C=C/C=C/C1=CC=CC=C1CCCCC(=O)OO)OC
InChI
InChI=1S/C25H38O4/c1-3-4-5-6-7-8-19-24(28-2)20-13-11-17-22-15-9-10-16-23(22)18-12-14-21-25(26)29-27/h9-11,13,15-17,20,24,27H,3-8,12,14,18-19,21H2,1-2H3/b17-11+,20-13+
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