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7-ACETOXY-2-CYCLOHEPTEN-1-ONE

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7-ACETOXY-2-CYCLOHEPTEN-1-ONE
SpectraBase Compound ID F7JAID3bpSP
InChI InChI=1S/C9H12O3/c1-7(10)12-9-6-4-2-3-5-8(9)11/h3,5,9H,2,4,6H2,1H3
InChIKey SIPUICOGUMKFHL-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zobSp1pwfJ
Name 7-ACETOXY-2-CYCLOHEPTEN-1-ONE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-7(10)12-9-6-4-2-3-5-8(9)11/h3,5,9H,2,4,6H2,1H3
InChIKey SIPUICOGUMKFHL-UHFFFAOYSA-N
Literature Reference Author R.FLORESCA,M.KURIHARA,D.S.WATT,A.DEMIR
Literature Reference Citation J.ORG.CHEM.,58,2196(1993)
Literature Reference DOI 10.1021/jo00060a040
Molecular Weight 168.192 g/mol
Solvent CDCl3
Source File Reference UWCS22397