CID 3163525

[2-amino-1-(4-fluorophenyl)ethyl]dimethylamine

Structural Information

Molecular Formula
C10H15FN2
SMILES
CN(C)C(CN)C1=CC=C(C=C1)F
InChI
InChI=1S/C10H15FN2/c1-13(2)10(7-12)8-3-5-9(11)6-4-8/h3-6,10H,7,12H2,1-2H3
InChIKey
UUQFFOAUNDPGNS-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-N,N-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

182.12193 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.12921 140.3
[M+Na]+ 205.11115 146.4
[M-H]- 181.11465 143.5
[M+NH4]+ 200.15575 160.1
[M+K]+ 221.08509 145.2
[M+H-H2O]+ 165.11919 132.8
[M+HCOO]- 227.12013 164.3
[M+CH3COO]- 241.13578 191.6
[M+Na-2H]- 203.09660 144.0
[M]+ 182.12138 137.8
[M]- 182.12248 137.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe