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exo-9-Bromo-6-sec-butyl-7-oxatetracyclo[6.3.0.0(2,6).0(3,7)]undec-4-ene
SpectraBase Compound ID KQxAXtICF1O
InChI InChI=1S/C14H19BrO/c1-3-7(2)14-5-4-8-9-6-10(11(8)14)13(16-14)12(9)15/h4-5,7-13H,3,6H2,1-2H3/t7?,8-,9+,10-,11-,12-,13-,14?/m0/s1
InChIKey ZGHXRJCFVYCQIT-RDRGDBCSSA-N
Mol Weight 283.21 g/mol
Molecular Formula C14H19BrO
Exact Mass 282.061928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IASLqjYWr
Name exo-9-Bromo-6-sec-butyl-7-oxatetracyclo[6.3.0.0(2,6).0(3,7)]undec-4-ene
Alternate Name(s) (2S,3R,6S,8S,9S)-9-bromo-6-[(1R)-1-methylpropyl]-7-oxatetracyclo[6.3.0.0(2,6).0(3,10)]undec-4-ene
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Formula C14H19BrO
InChI InChI=1S/C14H19BrO/c1-3-7(2)14-5-4-8-9-6-10(11(8)14)13(16-14)12(9)15/h4-5,7-13H,3,6H2,1-2H3/t7?,8-,9+,10-,11-,12-,13-,14?/m0/s1
InChIKey ZGHXRJCFVYCQIT-RDRGDBCSSA-N
Molecular Weight 283.209 g/mol
SMILES C12([C@]3([C@@]([C@@]4([C@@]([C@@](O2)([C@]3(C4)[H])[H])(Br)[H])[H])([H])C=C1)[H])C(CC)C
SPLASH splash10-00di-3950000000-d1d6dcb8bbf52cd9f238
Source of Spectrum F-49-11369-34
Wiley ID 789008