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3,3-DIMETHYL-1,5-BENZODIOXEPIN;(CHAIR-CONFORMATION)

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3,3-DIMETHYL-1,5-BENZODIOXEPIN;(CHAIR-CONFORMATION)
SpectraBase Compound ID 8rK3n6Ld946
InChI InChI=1S/C11H14O2/c1-11(2)7-12-9-5-3-4-6-10(9)13-8-11/h3-6H,7-8H2,1-2H3
InChIKey NIDLFHBUQNLNFC-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJ9DosPn9Vf
Name 3,3-DIMETHYL-1,5-BENZODIOXEPIN;(CHAIR-CONFORMATION)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-11(2)7-12-9-5-3-4-6-10(9)13-8-11/h3-6H,7-8H2,1-2H3
InChIKey NIDLFHBUQNLNFC-UHFFFAOYSA-N
Literature Reference Author D.MENARD,M.ST-JACQUES
Literature Reference Citation CAN.J.CHEM.,59,1160(1981)
Literature Reference DOI 10.1139/v81-170
Molecular Weight 178.231 g/mol
Solvent CHClF2
Source File Reference UWED365