CID 125801

P 1435

Structural Information

Molecular Formula
C14H22FN3O2
SMILES
CCN(CC)CCNC(=O)C1=C(C(=CC(=C1)F)N)OC
InChI
InChI=1S/C14H22FN3O2/c1-4-18(5-2)7-6-17-14(19)11-8-10(15)9-12(16)13(11)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
InChIKey
YXUZEOBWZYPTLH-UHFFFAOYSA-N
Compound name
3-amino-N-[2-(diethylamino)ethyl]-5-fluoro-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

283.16962 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.17690 166.8
[M+Na]+ 306.15884 174.6
[M+NH4]+ 301.20344 172.2
[M+K]+ 322.13278 169.7
[M-H]- 282.16234 167.8
[M+Na-2H]- 304.14429 170.1
[M]+ 283.16907 167.7
[M]- 283.17017 167.7
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

No patent data available for this compound.