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(5AS,9S,9AS)-1,3,5A,6,7,8,9,9A-OCTAHYDRO-1-OXO-SPIRO-(2-BENZOXEPIN-9,2'-OXIRANE)-4-CARBALDEHYDE
SpectraBase Compound ID jxnF7UiecO
InChI InChI=1S/C12H14O4/c13-5-8-4-9-2-1-3-12(7-16-12)10(9)11(14)15-6-8/h4-5,9-10H,1-3,6-7H2/t9-,10+,12+/m0/s1
InChIKey ZQTMHPFTTRDSJS-HOSYDEDBSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Elg49fjUeV
Name (5AS,9S,9AS)-1,3,5A,6,7,8,9,9A-OCTAHYDRO-1-OXO-SPIRO-(2-BENZOXEPIN-9,2'-OXIRANE)-4-CARBALDEHYDE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c13-5-8-4-9-2-1-3-12(7-16-12)10(9)11(14)15-6-8/h4-5,9-10H,1-3,6-7H2/t9-,10+,12+/m0/s1
InChIKey ZQTMHPFTTRDSJS-HOSYDEDBSA-N
Literature Reference Author M.KRENN,E.URBAN
Literature Reference Citation MH.CHEM.,133,127(2002)
Literature Reference DOI 10.1007/s706-002-8242-9
Molecular Weight 222.241 g/mol
Solvent CDCl3
Source File Reference UWKP5065