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2,3-Dimethoxy-5,7,8,9-tetrahydro-6H-benzo[a]cyclohepten-6-one
SpectraBase Compound ID dEodVVMOxS
InChI InChI=1S/C13H16O3/c1-15-12-7-9-4-3-5-11(14)6-10(9)8-13(12)16-2/h7-8H,3-6H2,1-2H3
InChIKey DXSOMQWOEYMXOP-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MSaFd4tgTT
Name 2,3-Dimethoxy-5,7,8,9-tetrahydro-6H-benzo[a]cyclohepten-6-one
Alternate Name(s) 2,3-Dimethoxy-5,7,8,9-tetrahydrobenzocyclohepten-6-one 2,3-Dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-one
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Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-15-12-7-9-4-3-5-11(14)6-10(9)8-13(12)16-2/h7-8H,3-6H2,1-2H3
InChIKey DXSOMQWOEYMXOP-UHFFFAOYSA-N
Molecular Weight 220.268 g/mol
SMILES c12c(cc(c(c2)OC)OC)CCCC(C1)=O
SPLASH splash10-07kg-4900000000-7001e4eabde1202a03e1
Source of Spectrum J-63-2872-25
Wiley ID 1219969