CID 54441

76644-53-6

Structural Information

Molecular Formula
C23H32N2O4
SMILES
CCN(CC)CCN(C1=CC=CC=C1C)C(=O)C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C23H32N2O4/c1-7-24(8-2)13-14-25(19-12-10-9-11-17(19)3)23(26)18-15-20(27-4)22(29-6)21(16-18)28-5/h9-12,15-16H,7-8,13-14H2,1-6H3
InChIKey
IBQAYSZDRZOQBL-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]-3,4,5-trimethoxy-N-(2-methylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.2362 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.243476 200.6
[M+Na]+ 423.225418 205.0
[M-H]- 399.228924 209.5
[M+NH4]+ 418.270023 212.4
[M+K]+ 439.199358 204.5
[M+H-H2O]+ 383.233460 190.4
[M+HCOO]- 445.234401 224.8
[M+CH3COO]- 459.250051 237.8
[M+Na-2H]- 421.210866 199.2
[M]+ 400.23565142 209.7
[M]- 400.23674858 209.7
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

No patent data available for this compound.