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Benzeneacetonitrile, .alpha.-[(2-bromocyclopropyl)methyl]-.alpha.-methyl-, trans-
SpectraBase Compound ID u8khBaSjIB
InChI InChI=1S/C13H14BrN/c1-13(9-15,8-10-7-12(10)14)11-5-3-2-4-6-11/h2-6,10,12H,7-8H2,1H3/t10-,12+,13?/m0/s1
InChIKey WZVYQTXMINUDNF-LQNXFFKNSA-N
Mol Weight 264.17 g/mol
Molecular Formula C13H14BrN
Exact Mass 263.030962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54eif7XEDOu
Name Benzeneacetonitrile, .alpha.-[(2-bromocyclopropyl)methyl]-.alpha.-methyl-, trans-
Alternate Name(s) 3-[(1R,2R)-2-bromocyclopropyl]-2-methyl-2-phenylpropanenitrile
CAS Registry Number 119819-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrN
InChI InChI=1S/C13H14BrN/c1-13(9-15,8-10-7-12(10)14)11-5-3-2-4-6-11/h2-6,10,12H,7-8H2,1H3/t10-,12+,13?/m0/s1
InChIKey WZVYQTXMINUDNF-LQNXFFKNSA-N
Molecular Weight 264.166 g/mol
SMILES [C@]1([C@](Br)(C1)[H])(CC(C#N)(c1ccccc1)C)[H]
SPLASH splash10-0ue9-6900000000-3920306826cb32838c29
Source of Spectrum J-54-2758-9
Wiley ID 1266789