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OOYCGMQJIWHWHA-QKPYMPQASA-N
SpectraBase Compound ID 1psYRGCKvh4
InChI InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-12,14H,3,6-9H2,1-2H3/b5-4-/t10-,11-,12-/m1/s1
InChIKey OOYCGMQJIWHWHA-QKPYMPQASA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOABLc4IW6H
Name Methyl di-epicurbate
Alternate Name(s) Methyl 3-hydroxy-2-(pentenyl)cyclopentane-1-acetate Methyl {3-hydroxy-2-[(1E)-1-pentenyl]cyclopentyl}acetate [(1R,2R,3R)-3-Hydroxy-2-((Z)-pent-2-enyl)-cyclopentyl]-acetic acid methyl ester Methyl 2-[(1R,2R,3R)-3-hydroxy-2-[(Z)-pent-2-enyl]cyclopentyl]acetate Methyl 2-[(1R,2R,3R)-3-oxidanyl-2-[(Z)-pent-2-enyl]cyclopentyl]ethanoate
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Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-12,14H,3,6-9H2,1-2H3/b5-4-/t10-,11-,12-/m1/s1
InChIKey OOYCGMQJIWHWHA-QKPYMPQASA-N
Molecular Weight 226.316 g/mol
SMILES O[C@]1([C@@]([C@@](CC(=O)OC)(CC1)[H])(C\C=C/CC)[H])[H]
SPLASH splash10-05o0-9800000000-c06d22624f7d1400c699
Source of Spectrum U-1994-1046-18
Wiley ID 766129