CID 2773242

3,5-bis(trifluoromethyl)styrene

Structural Information

Molecular Formula
C10H6F6
SMILES
C=CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C10H6F6/c1-2-6-3-7(9(11,12)13)5-8(4-6)10(14,15)16/h2-5H,1H2
InChIKey
LFICVUCVPKKPFF-UHFFFAOYSA-N
Compound name
1-ethenyl-3,5-bis(trifluoromethyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

505
Patents

240.03737 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.04465 167.3
[M+Na]+ 263.02659 173.1
[M+NH4]+ 258.07119 169.9
[M+K]+ 279.00053 168.1
[M-H]- 239.03009 161.1
[M+Na-2H]- 261.01204 168.1
[M]+ 240.03682 166.1
[M]- 240.03792 166.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe