CID 146155791

2416243-68-8

Structural Information

Molecular Formula
C3H5ClF3N
SMILES
C(C(C(F)(F)F)Cl)N
InChI
InChI=1S/C3H5ClF3N/c4-2(1-8)3(5,6)7/h2H,1,8H2
InChIKey
TZYASZBAIVAUFW-UHFFFAOYSA-N
Compound name
2-chloro-3,3,3-trifluoropropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.00626 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.01354 121.7
[M+Na]+ 169.99548 130.4
[M-H]- 145.99898 117.9
[M+NH4]+ 165.04008 143.3
[M+K]+ 185.96942 127.8
[M+H-H2O]+ 130.00352 116.2
[M+HCOO]- 192.00446 136.6
[M+CH3COO]- 206.02011 174.9
[M+Na-2H]- 167.98093 126.7
[M]+ 147.00571 116.8
[M]- 147.00681 116.8
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.