CID 14545

Aniline, n,n-bis(2-fluoroethyl)-, hydrochloride

Structural Information

Molecular Formula
C10H13F2N
SMILES
C1=CC=C(C=C1)N(CCF)CCF
InChI
InChI=1S/C10H13F2N/c11-6-8-13(9-7-12)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey
VTVNWWIMWDBJTE-UHFFFAOYSA-N
Compound name
N,N-bis(2-fluoroethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

185.10161 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.108886 138.1
[M+Na]+ 208.090828 144.4
[M-H]- 184.094334 139.9
[M+NH4]+ 203.135433 158.0
[M+K]+ 224.064768 142.7
[M+H-H2O]+ 168.098870 129.7
[M+HCOO]- 230.099811 161.7
[M+CH3COO]- 244.115461 188.3
[M+Na-2H]- 206.076276 144.1
[M]+ 185.10106142 136.5
[M]- 185.10215858 136.5
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