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Bicyclo[2.1.1]hexane-1-carboxylic acid, 4-(bromomethyl)-, 1,1-dimethylethyl ester
SpectraBase Compound ID 4aMbp3M7TQA
InChI InChI=1S/C12H19BrO2/c1-10(2,3)15-9(14)12-5-4-11(6-12,7-12)8-13/h4-8H2,1-3H3
InChIKey CJMGNRZIQKXKAW-UHFFFAOYSA-N
Mol Weight 275.19 g/mol
Molecular Formula C12H19BrO2
Exact Mass 274.056843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0fCMUbaMd7
Name Bicyclo[2.1.1]hexane-1-carboxylic acid, 4-(bromomethyl)-, 1,1-dimethylethyl ester
CAS Registry Number 122699-68-7
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Formula C12H19BrO2
InChI InChI=1S/C12H19BrO2/c1-10(2,3)15-9(14)12-5-4-11(6-12,7-12)8-13/h4-8H2,1-3H3
InChIKey CJMGNRZIQKXKAW-UHFFFAOYSA-N
Molecular Weight 275.186 g/mol
SMILES C12(C(OC(C)(C)C)=O)CC(C2)(CBr)CC1
SPLASH splash10-0a70-7920000000-4b9230c04fd49f45f669
Source of Spectrum J-54-4949-30
Synonyms tert-Butyl 4-(bromomethyl)bicyclo[2.1.1]hexane-1-carboxylate tert-Butyl 4-(hydroxymethyl)bicyclo[2.1.1]hexane-1-carboxylate
Wiley ID 1277765