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4-Cyano-7-trifluoromethyl-exo-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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3qk8IBRq1r
Name 4-cyano-7-trifluoromethyl-exo-tetracyclo[6.3.0.0(2,4).0(3,7)]undec-5-ene
Alternate Name(s) 4-cyano-7-trifluoromethyl-endo-tetracyclo[6.3.0.0(2,4).0(3,7)]undec-5-ene 5b-(trifluoromethyl)-2b,2c,3,4,5,5a,5b,5c-octahydro-2aH-cyclopenta[a]cyclopropa[cd]pentalene-2a-carbonitrile
CAS Registry Number 113429-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 239.241 g/mol
SMILES C12(C3C(C(F)(F)F)(C=C2)C2C(C13)CCC2)C#N
SPLASH splash10-001i-9000000000-ff35357a97dc4c0ba0e1
Source of Spectrum KC-1987-2338-15
Wiley ID 1241895