CID 60684061

Diethyl({2-[(3,3,3-trifluoropropyl)amino]ethyl})amine

Structural Information

Molecular Formula
C9H19F3N2
SMILES
CCN(CC)CCNCCC(F)(F)F
InChI
InChI=1S/C9H19F3N2/c1-3-14(4-2)8-7-13-6-5-9(10,11)12/h13H,3-8H2,1-2H3
InChIKey
CYHJFWKIQMHEPK-UHFFFAOYSA-N
Compound name
N',N'-diethyl-N-(3,3,3-trifluoropropyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.15004 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15732 148.3
[M+Na]+ 235.13926 153.3
[M-H]- 211.14276 145.5
[M+NH4]+ 230.18386 167.2
[M+K]+ 251.11320 152.7
[M+H-H2O]+ 195.14730 139.9
[M+HCOO]- 257.14824 168.8
[M+CH3COO]- 271.16389 197.4
[M+Na-2H]- 233.12471 152.2
[M]+ 212.14949 146.0
[M]- 212.15059 146.0
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.