CID 3078824

Benzamide, n-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-3,4-diethoxy-

Structural Information

Molecular Formula
C22H30N2O4
SMILES
CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)OCCN(C)C)OCC
InChI
InChI=1S/C22H30N2O4/c1-5-26-20-12-9-18(15-21(20)27-6-2)22(25)23-16-17-7-10-19(11-8-17)28-14-13-24(3)4/h7-12,15H,5-6,13-14,16H2,1-4H3,(H,23,25)
InChIKey
BWZAMDNWZPQAHM-UHFFFAOYSA-N
Compound name
N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4-diethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.22055 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.22783 196.1
[M+Na]+ 409.20977 199.8
[M-H]- 385.21327 203.3
[M+NH4]+ 404.25437 207.5
[M+K]+ 425.18371 198.0
[M+H-H2O]+ 369.21781 185.9
[M+HCOO]- 431.21875 220.1
[M+CH3COO]- 445.23440 230.3
[M+Na-2H]- 407.19522 196.6
[M]+ 386.22000 203.1
[M]- 386.22110 203.1
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