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2-Methyl-5-(4-bromophenyl)-3-(trifluoromethyl)penta-2Z,4E-dienenitrile
SpectraBase Compound ID 5Vblf630hbt
InChI InChI=1S/C13H9BrF3N/c1-9(8-18)12(13(15,16)17)7-4-10-2-5-11(14)6-3-10/h2-7H,1H3/b7-4+,12-9-
InChIKey AEEKBVIFFLGSDA-HBVNMUHFSA-N
Mol Weight 316.12 g/mol
Molecular Formula C13H9BrF3N
Exact Mass 314.987047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 572XnZlkYC4
Name 2-Methyl-5-(4-bromophenyl)-3-(trifluoromethyl)penta-2Z,4E-dienenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9BrF3N
InChI InChI=1S/C13H9BrF3N/c1-9(8-18)12(13(15,16)17)7-4-10-2-5-11(14)6-3-10/h2-7H,1H3/b7-4+,12-9-
InChIKey AEEKBVIFFLGSDA-HBVNMUHFSA-N
Molecular Weight 316.121 g/mol
SMILES C(\C(\C=C\c1ccc(cc1)Br)=C/(C#N)C)(F)(F)F
SPLASH splash10-014i-0693000000-ffae2146bb75c2fde6d8
Source of Spectrum KC-0-511-6
Synonyms (2Z,4E)-5-(4-bromophenyl)-2-methyl-3-(trifluoromethyl)-2,4-pentadienenitrile
Wiley ID 827447