CID 3838271

(1-cyclopropylethyl)(2,2,2-trifluoroethyl)amine hydrochloride

Structural Information

Molecular Formula
C7H12F3N
SMILES
CC(C1CC1)NCC(F)(F)F
InChI
InChI=1S/C7H12F3N/c1-5(6-2-3-6)11-4-7(8,9)10/h5-6,11H,2-4H2,1H3
InChIKey
OHRMZVJKNLPGPX-UHFFFAOYSA-N
Compound name
N-(1-cyclopropylethyl)-2,2,2-trifluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

167.09218 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.099456 126.9
[M+Na]+ 190.081398 134.9
[M-H]- 166.084904 127.6
[M+NH4]+ 185.126003 142.3
[M+K]+ 206.055338 132.6
[M+H-H2O]+ 150.089440 118.7
[M+HCOO]- 212.090381 146.3
[M+CH3COO]- 226.106031 185.4
[M+Na-2H]- 188.066846 132.4
[M]+ 167.09163142 124.2
[M]- 167.09272858 124.2
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

No patent data available for this compound.