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2-Methyl-5-(4-methylphenyl)-3-(trifluoromethyl)hepta-2Z,4E-dienenitrile
SpectraBase Compound ID B48QzYPS59H
InChI InChI=1S/C14H12F3N/c1-10-3-5-12(6-4-10)7-8-13(11(2)9-18)14(15,16)17/h3-8H,1-2H3/b8-7+,13-11-
InChIKey MTDPUTWAUOYWMD-ZXAHDXGASA-N
Mol Weight 251.25 g/mol
Molecular Formula C14H12F3N
Exact Mass 251.092184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUnB5RclKQf
Name 2-Methyl-5-(4-methylphenyl)-3-(trifluoromethyl)hepta-2Z,4E-dienenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12F3N
InChI InChI=1S/C14H12F3N/c1-10-3-5-12(6-4-10)7-8-13(11(2)9-18)14(15,16)17/h3-8H,1-2H3/b8-7+,13-11-
InChIKey MTDPUTWAUOYWMD-ZXAHDXGASA-N
Molecular Weight 251.252 g/mol
SMILES C(\C(\C=C\c1ccc(cc1)C)=C/(C#N)C)(F)(F)F
SPLASH splash10-014i-0390000000-c78bc2f4656b0fea1c4c
Source of Spectrum KC-0-511-6
Synonyms (2Z,4E)-2-Methyl-5-p-tolyl-3-trifluoromethyl-penta-2,4-dienenitrile (2Z,4E)-2-methyl-5-(4-methylphenyl)-3-(trifluoromethyl)penta-2,4-dienenitrile
Wiley ID 827444