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cis-6-Bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole
SpectraBase Compound ID 5f3kF9idX3I
InChI InChI=1S/C9H13BrO2/c1-9(2)11-7-4-3-6(10)5-8(7)12-9/h5,7-8H,3-4H2,1-2H3/t7-,8+/m1/s1
InChIKey UKJFIQZCWAJHHQ-SFYZADRCSA-N
Mol Weight 233.1 g/mol
Molecular Formula C9H13BrO2
Exact Mass 232.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E5Gf54BokEr
Name cis-6-Bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole
Comments Less than 3 mono-isotopic peaks
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Formula C9H13BrO2
InChI InChI=1S/C9H13BrO2/c1-9(2)11-7-4-3-6(10)5-8(7)12-9/h5,7-8H,3-4H2,1-2H3/t7-,8+/m1/s1
InChIKey UKJFIQZCWAJHHQ-SFYZADRCSA-N
Molecular Weight 233.105 g/mol
SMILES C1(O[C@]2(C=C(Br)CC[C@]2(O1)[H])[H])(C)C
SPLASH splash10-0006-9030000000-551a0eba53de9518a61b
Source of Spectrum B-44-948-1
Synonyms (3aR,7aS)-6-bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole
Wiley ID 1233242