CID 82416980

2-[1-(trifluoromethyl)cyclopropyl]ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1CC1(CCN)C(F)(F)F
InChI
InChI=1S/C6H10F3N/c7-6(8,9)5(1-2-5)3-4-10/h1-4,10H2
InChIKey
PNHPXCYHILVRKV-UHFFFAOYSA-N
Compound name
2-[1-(trifluoromethyl)cyclopropyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

153.07654 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.083816 123.3
[M+Na]+ 176.065758 132.6
[M-H]- 152.069264 124.0
[M+NH4]+ 171.110363 140.9
[M+K]+ 192.039698 130.8
[M+H-H2O]+ 136.073800 116.6
[M+HCOO]- 198.074741 143.0
[M+CH3COO]- 212.090391 180.7
[M+Na-2H]- 174.051206 130.5
[M]+ 153.07599142 120.3
[M]- 153.07708858 120.3
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

patents stripe