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2-ISOPROPYL-1,3-DIOXA-5,6-BENZOCYCLOHEPTENE;(CHAIR-CONFORMATION)
SpectraBase Compound ID SuF5MF0dK0
InChI InChI=1S/C12H16O2/c1-9(2)12-13-7-10-5-3-4-6-11(10)8-14-12/h3-6,9,12H,7-8H2,1-2H3
InChIKey WLYWICTYNHOBRH-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BHwSdAidqFf
Name 2-ISOPROPYL-1,3-DIOXA-5,6-BENZOCYCLOHEPTENE;(CHAIR-CONFORMATION)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-9(2)12-13-7-10-5-3-4-6-11(10)8-14-12/h3-6,9,12H,7-8H2,1-2H3
InChIKey WLYWICTYNHOBRH-UHFFFAOYSA-N
Literature Reference Author R.ST-AMOUR,M.ST-JACQUES
Literature Reference Citation CAN.J.CHEM.,61,109(1983)
Literature Reference DOI 10.1139/v83-019
Molecular Weight 192.258 g/mol
Solvent CHF2Cl:CD2Cl2=17:3
Source File Reference UWED423