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Methyl 1,2,3,4,9,10-Hexahydro-1-methyl-4-oxobenz[f]azulene-1-carboxylate
SpectraBase Compound ID FOcOdJijsD
InChI InChI=1S/C17H18O3/c1-17(16(19)20-2)10-9-13-14(17)8-7-11-5-3-4-6-12(11)15(13)18/h3-6H,7-10H2,1-2H3
InChIKey MCYYVMYTNDTDMZ-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4UfjwAoBOq
Name Methyl 1,2,3,4,9,10-Hexahydro-1-methyl-4-oxobenz[f]azulene-1-carboxylate
Alternate Name(s) Methyl 1-methyl-4-oxo-1,2,3,4,9,10-hexahydrobenzo[f]azulene-1-carboxylate
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Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-17(16(19)20-2)10-9-13-14(17)8-7-11-5-3-4-6-12(11)15(13)18/h3-6H,7-10H2,1-2H3
InChIKey MCYYVMYTNDTDMZ-UHFFFAOYSA-N
Molecular Weight 270.328 g/mol
SMILES C12=C(C(C(=O)OC)(C)CC2)CCc2c(C1=O)cccc2
SPLASH splash10-03k9-1590000000-2098b6941b709ed53795
Source of Spectrum F-48-7294-11
Wiley ID 1274619