CID 28875414

886365-83-9

Structural Information

Molecular Formula
C11H12F3N
SMILES
C1CC1(CN)C2=CC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C11H12F3N/c12-11(13,14)9-3-1-8(2-4-9)10(7-15)5-6-10/h1-4H,5-7,15H2
InChIKey
CXJPNOOLBLPGAZ-UHFFFAOYSA-N
Compound name
[1-[4-(trifluoromethyl)phenyl]cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.09218 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.099456 136.9
[M+Na]+ 238.081398 146.6
[M-H]- 214.084904 140.5
[M+NH4]+ 233.126003 152.2
[M+K]+ 254.055338 143.1
[M+H-H2O]+ 198.089440 129.0
[M+HCOO]- 260.090381 156.9
[M+CH3COO]- 274.106031 191.6
[M+Na-2H]- 236.066846 143.5
[M]+ 215.09163142 133.9
[M]- 215.09272858 133.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.