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(1S,4R,5S)-(2-chloroethyl)-3-oxabicyclo[3.3.0]oct-6-en-2-one
SpectraBase Compound ID VzcaeL8Tib
InChI InChI=1S/C9H11ClO2/c10-5-4-8-6-2-1-3-7(6)9(11)12-8/h1-2,6-8H,3-5H2/t6-,7+,8-/m1/s1
InChIKey SVUZQGMTOGQTMW-GJMOJQLCSA-N
Mol Weight 186.64 g/mol
Molecular Formula C9H11ClO2
Exact Mass 186.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2V6QrukN8RO
Name (1S,4R,5S)-(2-chloroethyl)-3-oxabicyclo[3.3.0]oct-6-en-2-one
Alternate Name(s) (3R,3aR,6aS)-3-(2-chloroethyl)-3,3a,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-one racemic 4-endo-(2-chloroethyl)-3-oxabicyclo[3.3.0]oct-6-en-2-one
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Formula C9H11ClO2
InChI InChI=1S/C9H11ClO2/c10-5-4-8-6-2-1-3-7(6)9(11)12-8/h1-2,6-8H,3-5H2/t6-,7+,8-/m1/s1
InChIKey SVUZQGMTOGQTMW-GJMOJQLCSA-N
Molecular Weight 186.638 g/mol
SMILES C1(O[C@@](CCCl)([H])[C@]2([C@@]1(CC=C2)[H])[H])=O
SPLASH splash10-014i-9000000000-2960596ed6fa1d4ea5b7
Source of Spectrum KC-0-2062-8
Wiley ID 784376