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N-(3-cyano-2-cyclohex-2-en-1-ylphenyl)-2,2,2-trifluoroacetamide
SpectraBase Compound ID GBePaFvuqRc
InChI InChI=1S/C15H13F3N2O/c16-15(17,18)14(21)20-12-8-4-7-11(9-19)13(12)10-5-2-1-3-6-10/h2,4-5,7-8,10H,1,3,6H2,(H,20,21)
InChIKey IZPQCOQTRKNNHB-UHFFFAOYSA-N
Mol Weight 294.28 g/mol
Molecular Formula C15H13F3N2O
Exact Mass 294.097998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xVwl8N0jo
Name N-(3-cyano-2-cyclohex-2-en-1-ylphenyl)-2,2,2-trifluoroacetamide
Alternate Name(s) N-(6-cyano-1',2',3',4'-tetrahydro-[1,1'-biphenyl]-2-yl)-2,2,2-trifluoroacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13F3N2O
InChI InChI=1S/C15H13F3N2O/c16-15(17,18)14(21)20-12-8-4-7-11(9-19)13(12)10-5-2-1-3-6-10/h2,4-5,7-8,10H,1,3,6H2,(H,20,21)
InChIKey IZPQCOQTRKNNHB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201205465
Molecular Weight 294.277 g/mol
SMILES N(c1c(C2C=CCCC2)c(ccc1)C#N)C(=O)C(F)(F)F
SPLASH splash10-002g-0490000000-91a015aea1fefa0bcc92
Source of Spectrum ACI-51-SM19-4j
Wiley ID 1780741