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5H-Benzocycloheptene-8-carboxylic acid, 6,7-dihydro-2-methoxy-5-oxo-, ethyl ester
SpectraBase Compound ID KxU4IT13o8Y
InChI InChI=1S/C15H16O4/c1-3-19-15(17)10-4-7-14(16)13-6-5-12(18-2)9-11(13)8-10/h5-6,8-9H,3-4,7H2,1-2H3
InChIKey ASWIQZPVHPREKR-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C15H16O4
Exact Mass 260.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrdMrRTUNzL
Name 5H-Benzocycloheptene-8-carboxylic acid, 6,7-dihydro-2-methoxy-5-oxo-, ethyl ester
Alternate Name(s) 3-Methoxy-9-oxo-7,8-dihydrobenzo[7]annulene-6-carboxylic acid ethyl ester Ethyl 3-methoxy-9-oxo-7,8-dihydrobenzo[7]annulene-6-carboxylate Ethyl 3-methoxy-9-oxidanylidene-7,8-dihydrobenzo[7]annulene-6-carboxylate
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Formula C15H16O4
InChI InChI=1S/C15H16O4/c1-3-19-15(17)10-4-7-14(16)13-6-5-12(18-2)9-11(13)8-10/h5-6,8-9H,3-4,7H2,1-2H3
InChIKey ASWIQZPVHPREKR-UHFFFAOYSA-N
Molecular Weight 260.289 g/mol
SMILES c12C=C(C(=O)OCC)CCC(c2ccc(c1)OC)=O
SPLASH splash10-07e0-1910000000-9fc3e8baa71766e4ef03
Source of Spectrum IY-1-4279-2
Wiley ID 1650784