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Benzo[a]cyclopropa[c]cycloheptene-1a(1H)-carboxylic acid, 2,8b-dihydro-2-oxo-, methyl ester, cis-
SpectraBase Compound ID IKGV1UeiUbn
InChI InChI=1S/C14H12O3/c1-17-13(16)14-8-11(14)10-5-3-2-4-9(10)6-7-12(14)15/h2-7,11H,8H2,1H3/t11-,14+/m0/s1
InChIKey LSMKRKZGFHRIJQ-SMDDNHRTSA-N
Mol Weight 228.25 g/mol
Molecular Formula C14H12O3
Exact Mass 228.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4S8BxWVGmHe
Name Benzo[a]cyclopropa[c]cycloheptene-1a(1H)-carboxylic acid, 2,8b-dihydro-2-oxo-, methyl ester, cis-
Alternate Name(s) 4-Methoxycarbonyl-tricyclo[6.4.0.0(2,4)]dodeca-1(8),7,9,11-tetraen-5-one Methyl (1aR,8bS)-2-oxo-2,8b-dihydrobenzo[a]cyclopropa[c]cycloheptene-1a(1H)-carboxylate
CAS Registry Number 118416-14-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O3
InChI InChI=1S/C14H12O3/c1-17-13(16)14-8-11(14)10-5-3-2-4-9(10)6-7-12(14)15/h2-7,11H,8H2,1H3/t11-,14+/m0/s1
InChIKey LSMKRKZGFHRIJQ-SMDDNHRTSA-N
Molecular Weight 228.247 g/mol
SMILES [C@@]12([C@@](c3c(cccc3)C=CC1=O)([H])C2)C(=O)OC
SPLASH splash10-00kg-0910000000-be0ccd6217ce3af33586
Source of Spectrum KC-1988-495-15
Wiley ID 1229926