CID 26190119

4-[2-(dimethylamino)ethoxy]-3-fluoroaniline

Structural Information

Molecular Formula
C10H15FN2O
SMILES
CN(C)CCOC1=C(C=C(C=C1)N)F
InChI
InChI=1S/C10H15FN2O/c1-13(2)5-6-14-10-4-3-8(12)7-9(10)11/h3-4,7H,5-6,12H2,1-2H3
InChIKey
AUQIARDFDSUERW-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethoxy]-3-fluoroaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

198.11684 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.12412 142.6
[M+Na]+ 221.10606 149.9
[M-H]- 197.10956 146.1
[M+NH4]+ 216.15066 162.1
[M+K]+ 237.08000 148.8
[M+H-H2O]+ 181.11410 135.1
[M+HCOO]- 243.11504 167.9
[M+CH3COO]- 257.13069 193.9
[M+Na-2H]- 219.09151 146.9
[M]+ 198.11629 142.7
[M]- 198.11739 142.7
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