CID 988127

303061-76-9

Structural Information

Molecular Formula
C23H22N2O4
SMILES
COC1=C(C=C(C=C1)C(NC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)OC
InChI
InChI=1S/C23H22N2O4/c1-28-19-14-13-18(15-20(19)29-2)21(24-22(26)16-9-5-3-6-10-16)25-23(27)17-11-7-4-8-12-17/h3-15,21H,1-2H3,(H,24,26)(H,25,27)
InChIKey
VQUUWSDGXVHYBZ-UHFFFAOYSA-N
Compound name
N-[benzamido-(3,4-dimethoxyphenyl)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.15796 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.165236 193.4
[M+Na]+ 413.147178 196.5
[M-H]- 389.150684 202.4
[M+NH4]+ 408.191783 202.8
[M+K]+ 429.121118 193.3
[M+H-H2O]+ 373.155220 182.7
[M+HCOO]- 435.156161 216.0
[M+CH3COO]- 449.171811 225.4
[M+Na-2H]- 411.132626 195.2
[M]+ 390.15741142 194.4
[M]- 390.15850858 194.4
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.