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

No literature data available for this compound.

Patent stripe

patents stripe