CID 61350856

1247567-61-8

Structural Information

Molecular Formula
C11H17FN2
SMILES
CCN(CCN)CC1=CC(=CC=C1)F
InChI
InChI=1S/C11H17FN2/c1-2-14(7-6-13)9-10-4-3-5-11(12)8-10/h3-5,8H,2,6-7,9,13H2,1H3
InChIKey
CYSKDKJKTCAVEI-UHFFFAOYSA-N
Compound name
N'-ethyl-N'-[(3-fluorophenyl)methyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.13757 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.14485 144.1
[M+Na]+ 219.12679 154.4
[M+NH4]+ 214.17139 152.2
[M+K]+ 235.10073 147.6
[M-H]- 195.13029 146.5
[M+Na-2H]- 217.11224 150.5
[M]+ 196.13702 146.0
[M]- 196.13812 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.