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(3Z,4R,5S)-3-(chloranylmethylidene)-4-(chloromethyl)-5-propyl-oxolan-2-one
SpectraBase Compound ID 7QGyM35SVFD
InChI InChI=1S/C9H12Cl2O2/c1-2-3-8-6(4-10)7(5-11)9(12)13-8/h5-6,8H,2-4H2,1H3/b7-5-/t6-,8+/m1/s1
InChIKey VVGNDTQBQKQDDI-BQHCTPAVSA-N
Mol Weight 223.1 g/mol
Molecular Formula C9H12Cl2O2
Exact Mass 222.021435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yKxUW2RVpN
Name (3Z,4R,5S)-3-(chloranylmethylidene)-4-(chloromethyl)-5-propyl-oxolan-2-one
Alternate Name(s) (3Z,4R,5S)-4-(chloromethyl)-3-(chloromethylene)-5-propyl-tetrahydrofuran-2-one (3Z,4R,5S)-4-(chloromethyl)-3-(chloromethylidene)-5-propyl-2-oxolanone (3Z,4R,5S)-4-(chloromethyl)-3-(chloromethylidene)-5-propyloxolan-2-one
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Formula C9H12Cl2O2
InChI InChI=1S/C9H12Cl2O2/c1-2-3-8-6(4-10)7(5-11)9(12)13-8/h5-6,8H,2-4H2,1H3/b7-5-/t6-,8+/m1/s1
InChIKey VVGNDTQBQKQDDI-BQHCTPAVSA-N
Molecular Weight 223.099 g/mol
SMILES C1(\C([C@]([C@@](O1)(CCC)[H])(CCl)[H])=C/Cl)=O
SPLASH splash10-01di-3790000000-6d306ce64fd1b0587466
Source of Spectrum D1-1993-747-2
Wiley ID 834489