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5,6,7,8,9,9a-hexahydro-1H-benzocycloheptene-2-carboxylic acid methyl ester
SpectraBase Compound ID EmLyTfivest
InChI InChI=1S/C13H18O2/c1-15-13(14)12-8-7-10-5-3-2-4-6-11(10)9-12/h7-8,11H,2-6,9H2,1H3
InChIKey NSJBLJMXCJZVHI-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8VNGsjhEU2N
Name BENZOCYCLOHEPTENE-2-CARBOXYLIC ACID, 5,6,7,8,9,9a-HEXAHYDRO- METHYL ESTER,
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-15-13(14)12-8-7-10-5-3-2-4-6-11(10)9-12/h7-8,11H,2-6,9H2,1H3
InChIKey NSJBLJMXCJZVHI-UHFFFAOYSA-N
Instrument Name BRUKER AM-360
NMR Standard TMS
Solvent CDCL3