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(-)-(1S,2S)-5,6-Dimethylidene-2-endo-bicyclo[2.2.2]octyl p-bromobenzoate
SpectraBase Compound ID AJoz1ZkSdM9
InChI InChI=1S/C17H17BrO2/c1-10-11(2)15-8-5-13(10)9-16(15)20-17(19)12-3-6-14(18)7-4-12/h3-4,6-7,13,15-16H,1-2,5,8-9H2/t13-,15+,16+/m1/s1
InChIKey IIURVWRGNXIUGA-KBMXLJTQSA-N
Mol Weight 333.23 g/mol
Molecular Formula C17H17BrO2
Exact Mass 332.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlqYcASfpa5
Name (-)-(1S,2S)-5,6-Dimethylidene-2-endo-bicyclo[2.2.2]octyl p-bromobenzoate
Alternate Name(s) (1S,2S,4R)-5,6-dimethylenebicyclo[2.2.2]octan-2-yl 4-bromobenzoate
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Formula C17H17BrO2
InChI InChI=1S/C17H17BrO2/c1-10-11(2)15-8-5-13(10)9-16(15)20-17(19)12-3-6-14(18)7-4-12/h3-4,6-7,13,15-16H,1-2,5,8-9H2/t13-,15+,16+/m1/s1
InChIKey IIURVWRGNXIUGA-KBMXLJTQSA-N
Molecular Weight 333.225 g/mol
SMILES C1([C@@]2(CC[C@@](C1=C)(C[C@@]2(OC(c1ccc(cc1)Br)=O)[H])[H])[H])=C
SPLASH splash10-001r-0901000000-49b57a04adb3041fa7ce
Source of Spectrum H-67-610-25
Wiley ID 1800072