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2,2-Dimethyl-4-phenylbutanitrile
SpectraBase Compound ID L3xmRGlyMun
InChI InChI=1S/C12H13N/c1-12(2,10-13)9-8-11-6-4-3-5-7-11/h3-9H,1-2H3/b9-8+
InChIKey SDRBCKKWZLLTJC-CMDGGOBGSA-N
Mol Weight 171.24 g/mol
Molecular Formula C12H13N
Exact Mass 171.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dfdTJxvWUj
Name 2,2-Dimethyl-4-phenylbutanitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N
InChI InChI=1S/C12H13N/c1-12(2,10-13)9-8-11-6-4-3-5-7-11/h3-9H,1-2H3/b9-8+
InChIKey SDRBCKKWZLLTJC-CMDGGOBGSA-N
Molecular Weight 171.243 g/mol
SMILES C(#N)C(\C=C\c1ccccc1)(C)C
SPLASH splash10-0a4i-9000000000-208ecbb0d81ac1eacecd
Source of Spectrum F-67-9404-26
Synonyms (E)-2,2-dimethyl-4-phenyl-3-butenenitrile (E)-2,2-dimethyl-4-phenylbut-3-enenitrile
Wiley ID 1571503