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2-(1-(4-(Trifluoromethyl)phenyl)propyl)succinonitrile
SpectraBase Compound ID 2SxL4KGrxXy
InChI InChI=1S/C14H13F3N2/c1-2-13(11(9-19)7-8-18)10-3-5-12(6-4-10)14(15,16)17/h3-6,11,13H,2,7H2,1H3
InChIKey DAFUJQPEKFRYCX-UHFFFAOYSA-N
Mol Weight 266.27 g/mol
Molecular Formula C14H13F3N2
Exact Mass 266.103083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ln1j4wd4mx9
Name 2-(1-(4-(Trifluoromethyl)phenyl)propyl)succinonitrile
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13F3N2
InChI InChI=1S/C14H13F3N2/c1-2-13(11(9-19)7-8-18)10-3-5-12(6-4-10)14(15,16)17/h3-6,11,13H,2,7H2,1H3
InChIKey DAFUJQPEKFRYCX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901135
Molecular Weight 266.267 g/mol
Reported Formula C14H13F3N2
SMILES c1(ccc(cc1)C(CC)C(CC#N)C#N)C(F)(F)F
SPLASH splash10-0a4i-0900000000-82a575e392a13319d2f1
Sample Comments dr = 1.3:1
Source of Spectrum U1-2020-SM12-3g-.alpha.
Wiley ID 1858825