CID 3154220

[2-(dimethylamino)ethyl][(2-fluorophenyl)methyl]amine

Structural Information

Molecular Formula
C11H17FN2
SMILES
CN(C)CCNCC1=CC=CC=C1F
InChI
InChI=1S/C11H17FN2/c1-14(2)8-7-13-9-10-5-3-4-6-11(10)12/h3-6,13H,7-9H2,1-2H3
InChIKey
HTBXSNPURUNNNU-UHFFFAOYSA-N
Compound name
N-[(2-fluorophenyl)methyl]-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

196.13757 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.144846 143.8
[M+Na]+ 219.126788 149.7
[M-H]- 195.130294 147.2
[M+NH4]+ 214.171393 163.4
[M+K]+ 235.100728 148.2
[M+H-H2O]+ 179.134830 136.0
[M+HCOO]- 241.135771 169.2
[M+CH3COO]- 255.151421 194.5
[M+Na-2H]- 217.112236 149.4
[M]+ 196.13702142 143.4
[M]- 196.13811858 143.4
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