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5-(3-Nitrophenyl)-3-trifluoromethylpenta-2E,4E-dienenitrile
SpectraBase Compound ID 5jEaWqC2NlW
InChI InChI=1S/C12H7F3N2O2/c13-12(14,15)10(6-7-16)5-4-9-2-1-3-11(8-9)17(18)19/h1-6,8H/b5-4+,10-6+
InChIKey SNNDXDVSICFQRU-UMCKCUICSA-N
Mol Weight 268.2 g/mol
Molecular Formula C12H7F3N2O2
Exact Mass 268.045962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G09OnlOtSGU
Name 5-(3-Nitrophenyl)-3-trifluoromethylpenta-2E,4E-dienenitrile
Alternate Name(s) (2E,4E)-5-(3-nitrophenyl)-3-(trifluoromethyl)-2,4-pentadienenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F3N2O2
InChI InChI=1S/C12H7F3N2O2/c13-12(14,15)10(6-7-16)5-4-9-2-1-3-11(8-9)17(18)19/h1-6,8H/b5-4+,10-6+
InChIKey SNNDXDVSICFQRU-UMCKCUICSA-N
Molecular Weight 268.195 g/mol
SMILES c1(N(=O)=O)cc(\C=C\C(C(F)(F)F)=C/C#N)ccc1
SPLASH splash10-0uxr-2090000000-d447cba70bc3e7b31c93
Source of Spectrum SO-0-2679-7
Wiley ID 864808