For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-cyano-4-trifluoromethyl-endo-tetracyclo[6.3.0.0(2,4).0(3,7)]undec-5-ene
SpectraBase Compound ID 9cTgOBsVM7y
InChI InChI=1S/C13H12F3N/c14-13(15,16)12-4-6(5-17)9-7-2-1-3-8(7)10(12)11(9)12/h4,7-11H,1-3H2
InChIKey RTTVAENZOHGADT-UHFFFAOYSA-N
Mol Weight 239.24 g/mol
Molecular Formula C13H12F3N
Exact Mass 239.092184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DXz48k7LMBm
Name 6-cyano-4-trifluoromethyl-endo-tetracyclo[6.3.0.0(2,4).0(3,7)]undec-5-ene
CAS Registry Number 113429-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F3N
InChI InChI=1S/C13H12F3N/c14-13(15,16)12-4-6(5-17)9-7-2-1-3-8(7)10(12)11(9)12/h4,7-11H,1-3H2
InChIKey RTTVAENZOHGADT-UHFFFAOYSA-N
Molecular Weight 239.241 g/mol
SMILES C12(C3C(C(=C2)C#N)C2C(C13)CCC2)C(F)(F)F
SPLASH splash10-001i-9000000000-38b1b969271b63afbcda
Source of Spectrum KC-1987-2338-18
Synonyms 2a-(trifluoromethyl)-2b,2c,3,4,5,5a,5b,5c-octahydro-2aH-cyclopenta[a]cyclopropa[cd]pentalene-1-carbonitrile
Wiley ID 1241896