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2(3H)-Furanone, 5-(1-bromoethyl)dihydro-3-methyl-, [3.alpha.,5.beta.(R*)]-
SpectraBase Compound ID AjQddTrHcP3
InChI InChI=1S/C7H11BrO2/c1-4-3-6(5(2)8)10-7(4)9/h4-6H,3H2,1-2H3/t4-,5-,6+/m1/s1
InChIKey IIAHHDQTUGOHSX-PBXRRBTRSA-N
Mol Weight 207.07 g/mol
Molecular Formula C7H11BrO2
Exact Mass 205.994243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9s7cU1DqYlp
Name 2(3H)-Furanone, 5-(1-bromoethyl)dihydro-3-methyl-, [3.alpha.,5.beta.(R*)]-
Alternate Name(s) (3R,5S)-5-[(1R)-1-bromoethyl]-3-methyldihydro-2(3H)-furanone trans-2-methyl-4-(1-bromoethyl)-.gamma.-butyrolactone
CAS Registry Number 88431-12-3
Comments Removed - expert review: contamination (chloroform))
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Formula C7H11BrO2
InChI InChI=1S/C7H11BrO2/c1-4-3-6(5(2)8)10-7(4)9/h4-6H,3H2,1-2H3/t4-,5-,6+/m1/s1
InChIKey IIAHHDQTUGOHSX-PBXRRBTRSA-N
Molecular Weight 207.067 g/mol
SMILES C1(O[C@@](C[C@]1(C)[H])([C@](Br)(C)[H])[H])=O
SPLASH splash10-001t-9000000000-1702a2c3b54c63524f49
Source of Spectrum C-106-1084-0
Wiley ID 1203769