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Methyl 8-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-endo-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 8-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-endo-carboxylate
SpectraBase Compound ID 1PnEo4wHuIW
InChI InChI=1S/C9H9ClO4/c1-13-8(11)5-2-4-6(10)3-7(5)14-9(4)12/h3-5,7H,2H2,1H3/t4-,5?,7-/m0/s1
InChIKey SCKWAAZUUBEPQR-VZWBMFKNSA-N
Mol Weight 216.62 g/mol
Molecular Formula C9H9ClO4
Exact Mass 216.018936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MXcpYSkon5
Name Methyl 8-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-endo-carboxylate
Alternate Name(s) Methyl 8-chloro-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClO4
InChI InChI=1S/C9H9ClO4/c1-13-8(11)5-2-4-6(10)3-7(5)14-9(4)12/h3-5,7H,2H2,1H3/t4-,5?,7-/m0/s1
InChIKey SCKWAAZUUBEPQR-VZWBMFKNSA-N
Molecular Weight 216.620 g/mol
SMILES [C@@]12(OC([C@@](CC2C(=O)OC)(C(=C1)Cl)[H])=O)[H]
SPLASH splash10-03di-0900000000-12926f17e9413bbf15c6
Source of Spectrum F-68-7165-10
Wiley ID 1573349