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syn-7-Bromo-endo-6-phenylbicyclo[3.1.1]heptane carbonitrile
SpectraBase Compound ID DyPHgL4tVql
InChI InChI=1S/C14H14BrN/c15-13-11-7-4-8-14(13,9-16)12(11)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-8H2/t11-,12?,13?,14-/m1/s1
InChIKey JAVJAZDINGXQHV-BLYZHGLHSA-N
Mol Weight 276.18 g/mol
Molecular Formula C14H14BrN
Exact Mass 275.030962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jmk6QMMzo
Name syn-7-Bromo-endo-6-phenylbicyclo[3.1.1]heptane carbonitrile
Alternate Name(s) 6-Bromo-7-phenylbicyclo[3.1.1]heptane-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14BrN
InChI InChI=1S/C14H14BrN/c15-13-11-7-4-8-14(13,9-16)12(11)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-8H2/t11-,12?,13?,14-/m1/s1
InChIKey JAVJAZDINGXQHV-BLYZHGLHSA-N
Molecular Weight 276.177 g/mol
SMILES [C@@]12(C(c3ccccc3)[C@](C1Br)(CCC2)[H])C#N
SPLASH splash10-014i-1900000000-b1f9d64a96488708e3f9
Source of Spectrum K-127-388-16
Wiley ID 1279002