CID 57955

100678-34-0

Structural Information

Molecular Formula
C20H27N3O2
SMILES
CCN(CC)CCN(C1=CC=CC=C1N)C(=O)C2=CC=C(C=C2)OC
InChI
InChI=1S/C20H27N3O2/c1-4-22(5-2)14-15-23(19-9-7-6-8-18(19)21)20(24)16-10-12-17(25-3)13-11-16/h6-13H,4-5,14-15,21H2,1-3H3
InChIKey
LUZKHZZVDYHFLK-UHFFFAOYSA-N
Compound name
N-(2-aminophenyl)-N-[2-(diethylamino)ethyl]-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.21033 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.21761 185.9
[M+Na]+ 364.19955 189.2
[M-H]- 340.20305 194.0
[M+NH4]+ 359.24415 199.1
[M+K]+ 380.17349 187.6
[M+H-H2O]+ 324.20759 175.9
[M+HCOO]- 386.20853 211.1
[M+CH3COO]- 400.22418 226.9
[M+Na-2H]- 362.18500 186.6
[M]+ 341.20978 188.5
[M]- 341.21088 188.5
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

No patent data available for this compound.