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]+ 168.09946 126.9
[M+Na]+ 190.08140 134.9
[M-H]- 166.08490 127.6
[M+NH4]+ 185.12600 142.3
[M+K]+ 206.05534 132.6
[M+H-H2O]+ 150.08944 118.7
[M+HCOO]- 212.09038 146.3
[M+CH3COO]- 226.10603 185.4
[M+Na-2H]- 188.06685 132.4
[M]+ 167.09163 124.2
[M]- 167.09273 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.