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(3Z,4R,5S)-3-(bromanylmethylidene)-4-ethenyl-5-pentyl-oxolan-2-one
SpectraBase Compound ID 27Sv8F1oN2v
InChI InChI=1S/C12H17BrO2/c1-3-5-6-7-11-9(4-2)10(8-13)12(14)15-11/h4,8-9,11H,2-3,5-7H2,1H3/b10-8-/t9-,11+/m1/s1
InChIKey NGFKHFKSXAAMIX-QTCFEDSUSA-N
Mol Weight 273.17 g/mol
Molecular Formula C12H17BrO2
Exact Mass 272.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkGREV513qN
Name (3Z,4R,5S)-3-(bromanylmethylidene)-4-ethenyl-5-pentyl-oxolan-2-one
Alternate Name(s) (3Z,4R,5S)-3-(bromomethylene)-5-pentyl-4-vinyl-tetrahydrofuran-2-one (3Z,4R,5S)-3-(bromomethylidene)-4-ethenyl-5-pentyl-2-oxolanone (3Z,4R,5S)-3-(bromomethylidene)-4-ethenyl-5-pentyloxolan-2-one (3Z,4R,5S)-5-amyl-3-(bromomethylene)-4-vinyl-tetrahydrofuran-2-one
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Formula C12H17BrO2
InChI InChI=1S/C12H17BrO2/c1-3-5-6-7-11-9(4-2)10(8-13)12(14)15-11/h4,8-9,11H,2-3,5-7H2,1H3/b10-8-/t9-,11+/m1/s1
InChIKey NGFKHFKSXAAMIX-QTCFEDSUSA-N
Molecular Weight 273.170 g/mol
SMILES C1(\C([C@]([C@@](O1)(CCCCC)[H])(C=C)[H])=C/Br)=O
SPLASH splash10-00dl-6910000000-04c20e8b823c3aa26955
Source of Spectrum J-60-1088-4
Wiley ID 1275787