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Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 2-(2-oxopropyl)-, methyl ester
SpectraBase Compound ID G3lR7EnMlyV
InChI InChI=1S/C12H16O3/c1-8(13)6-12(11(14)15-2)7-9-3-4-10(12)5-9/h3-4,9-10H,5-7H2,1-2H3
InChIKey XRJMTAMQNNJRJU-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EKSyvoVSEI
Name Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 2-(2-oxopropyl)-, methyl ester
Alternate Name(s) Methyl 2-(2-oxopropyl)bicyclo[2.2.1]hept-5-ene-2-carboxylate 5-(2-oxopropyl)-5-bicyclo[2.2.1]hept-2-enecarboxylic acid methyl ester Methyl 5-(2-oxopropyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate Methyl 5-acetonylbicyclo[2.2.1]hept-2-ene-5-carboxylate Methyl 5-(2-oxidanylidenepropyl)bicyclo[2.2.1]hept-2-ene-5-carboxylate
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Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-8(13)6-12(11(14)15-2)7-9-3-4-10(12)5-9/h3-4,9-10H,5-7H2,1-2H3
InChIKey XRJMTAMQNNJRJU-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES COC(C1(CC2CC1C=C2)CC(C)=O)=O
SPLASH splash10-014l-9100000000-3b16ab514fc0bf1b7822
Source of Spectrum JX-2015-5-933
Wiley ID 1727666