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Methyl 2-(3-oxocyclohex-1-enylmethyl)furan-3-carboxylate
SpectraBase Compound ID Jxb6Mpj3xfe
InChI InChI=1S/C13H14O4/c1-16-13(15)11-5-6-17-12(11)8-9-3-2-4-10(14)7-9/h5-7H,2-4,8H2,1H3
InChIKey DXCIUQIJFHALKF-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BxtpyMFsCK
Name Methyl 2-(3-oxocyclohex-1-enylmethyl)furan-3-carboxylate
Alternate Name(s) Methyl 2-[(3-oxo-1-cyclohexen-1-yl)methyl]-3-furoate 2-[(3-oxo-1-cyclohexenyl)methyl]-3-furancarboxylic acid methyl ester Methyl 2-[(3-oxocyclohexen-1-yl)methyl]furan-3-carboxylate Methyl 2-[(3-oxidanylidenecyclohexen-1-yl)methyl]furan-3-carboxylate
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Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-16-13(15)11-5-6-17-12(11)8-9-3-2-4-10(14)7-9/h5-7H,2-4,8H2,1H3
InChIKey DXCIUQIJFHALKF-UHFFFAOYSA-N
Molecular Weight 234.251 g/mol
SMILES c1(occc1C(=O)OC)CC1=CC(CCC1)=O
SPLASH splash10-001j-7790000000-b973781868f8c415339a
Source of Spectrum KC-1993-242-8
Wiley ID 778894