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4-Acetyl-3-ethyl-8-(methoxycarbonyl)bicyclo[3.3.0]oct-3-en-2-one
SpectraBase Compound ID IFw4MogM37h
InChI InChI=1S/C14H18O4/c1-4-8-11(7(2)15)9-5-6-10(14(17)18-3)12(9)13(8)16/h9-10,12H,4-6H2,1-3H3/t9-,10-,12+/m0/s1
InChIKey DEIMKMWSDIEJNH-JBLDHEPKSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rbbSRIz11u
Name 4-Acetyl-3-ethyl-8-(methoxycarbonyl)bicyclo[3.3.0]oct-3-en-2-one
Alternate Name(s) (1S,3aR,6aR)-4-Acetyl-5-ethyl-6-oxo-1,2,3,3a,6,6a-hexahydro-pentalene-1-carboxylic acid methyl ester Methyl 4-acetyl-5-ethyl-6-oxo-1,2,3,3a,6,6a-hexahydro-1-pentalenecarboxylate
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Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-4-8-11(7(2)15)9-5-6-10(14(17)18-3)12(9)13(8)16/h9-10,12H,4-6H2,1-3H3/t9-,10-,12+/m0/s1
InChIKey DEIMKMWSDIEJNH-JBLDHEPKSA-N
Molecular Weight 250.294 g/mol
SMILES C=1(C([C@]2([C@@](C(=O)OC)(CC[C@]2(C1C(=O)C)[H])[H])[H])=O)CC
SPLASH splash10-00kf-4920000000-2fcd12609acbea8bd42d
Source of Spectrum C-114-10458-17
Wiley ID 1253379