CID 64565127

1-(3,3,3-trifluoropropyl)azetidin-3-amine

Structural Information

Molecular Formula
C6H11F3N2
SMILES
C1C(CN1CCC(F)(F)F)N
InChI
InChI=1S/C6H11F3N2/c7-6(8,9)1-2-11-3-5(10)4-11/h5H,1-4,10H2
InChIKey
SLAOJCJLHUAWQS-UHFFFAOYSA-N
Compound name
1-(3,3,3-trifluoropropyl)azetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

168.08743 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09471 144.5
[M+Na]+ 191.07665 147.2
[M+NH4]+ 186.12125 146.2
[M+K]+ 207.05059 144.4
[M-H]- 167.08015 138.3
[M+Na-2H]- 189.06210 143.9
[M]+ 168.08688 141.6
[M]- 168.08798 141.6
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