CID 96667

Benzaldehyde, p-(bis(2-fluoroethyl)amino)-

Structural Information

Molecular Formula
C11H13F2NO
SMILES
C1=CC(=CC=C1C=O)N(CCF)CCF
InChI
InChI=1S/C11H13F2NO/c12-5-7-14(8-6-13)11-3-1-10(9-15)2-4-11/h1-4,9H,5-8H2
InChIKey
CAEWGNXPCYMVCH-UHFFFAOYSA-N
Compound name
4-[bis(2-fluoroethyl)amino]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09653 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.10381 147.4
[M+Na]+ 236.08575 157.6
[M+NH4]+ 231.13035 154.3
[M+K]+ 252.05969 150.8
[M-H]- 212.08925 147.3
[M+Na-2H]- 234.07120 152.9
[M]+ 213.09598 148.6
[M]- 213.09708 148.6
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

No patent data available for this compound.