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2-Methoxy-5,6-dihydro-4a,7-methano-4aH-benzocyclohepten-8(7H)-one
SpectraBase Compound ID 9zJA1MQ06MQ
InChI InChI=1S/C13H14O2/c1-15-11-3-5-13-4-2-9(8-13)12(14)7-10(13)6-11/h3,5-7,9H,2,4,8H2,1H3
InChIKey YNTIUXFSMWYZKS-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lO5H2cvEqb
Name 2-Methoxy-5,6-dihydro-4a,7-methano-4aH-benzocyclohepten-8(7H)-one
Alternate Name(s) 4-Methoxytricyclo[7.2.1.0(1,6)]dodeca-2,4,6-trien-8-one
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Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-15-11-3-5-13-4-2-9(8-13)12(14)7-10(13)6-11/h3,5-7,9H,2,4,8H2,1H3
InChIKey YNTIUXFSMWYZKS-UHFFFAOYSA-N
Molecular Weight 202.253 g/mol
SMILES C=12C3(C=CC(=C2)OC)CC(C(C1)=O)CC3
SPLASH splash10-0w59-4910000000-cee057ff0dcc6c62218d
Source of Spectrum SO-0-462-14
Wiley ID 875369