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4-Cyano-7-trifluoromethyl-endo-tetracyclo(6.3.0.0/2,4/,0/3,7/)undec-5-ene

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4-Cyano-7-trifluoromethyl-endo-tetracyclo(6.3.0.0/2,4/,0/3,7/)undec-5-ene
SpectraBase Compound ID I6qf2KGisMP
InChI InChI=1S/C13H12F3N/c14-13(15,16)12-5-4-11(6-17)9(10(11)12)7-2-1-3-8(7)12/h4-5,7-10H,1-3H2
InChIKey QBYJSJHNTFNHLY-UHFFFAOYSA-N
Mol Weight 239.24 g/mol
Molecular Formula C13H12F3N
Exact Mass 239.092184 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87rEWAgekUc
Name 4-Cyano-7-trifluoromethyl-exo-tetracyclo(6.3.0.0/2,4/.0/3,7/)undec-5-ene
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C13H12F3N
InChI InChI=1S/C13H12F3N/c14-13(15,16)12-5-4-11(6-17)9(10(11)12)7-2-1-3-8(7)12/h4-5,7-10H,1-3H2
InChIKey QBYJSJHNTFNHLY-UHFFFAOYSA-N
Instrument Name Bruker WH-270
Literature Reference G. Weber, J. Runsink, F. Mattay, J. Chem. Soc. Perkin I 2333 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3