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METHYL-4,5-DIDEHYDRO-JASMONATE
SpectraBase Compound ID 4ZSNOBBPrM2
InChI InChI=1S/C13H18O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,7-8,10-11H,3,6,9H2,1-2H3/b5-4-/t10-,11-/m1/s1
InChIKey RRZQRPDFHNQSJD-WQMVXFAESA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuxlDM8h5VR
Name 2-[(1S,5R)-4-keto-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]acetic acid methyl ester
Alternate Name(s) 2-[(1S,5R)-4-oxo-5-[(Z)-pent-2-enyl]-1-cyclopent-2-enyl]acetic acid methyl ester Methyl 2-[(1S,5R)-4-oxidanylidene-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]ethanoate Methyl 2-[(1S,5R)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]acetate
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,7-8,10-11H,3,6,9H2,1-2H3/b5-4-/t10-,11-/m1/s1
InChIKey RRZQRPDFHNQSJD-WQMVXFAESA-N
Molecular Weight 222.284 g/mol
SMILES [C@]1(C=CC([C@@]1(C\C=C/CC)[H])=O)(CC(=O)OC)[H]
SPLASH splash10-0f6t-4910000000-ff7f930bb75562471f6d
Source of Spectrum F-53-8193-17
Wiley ID 802448