CID 9574487

2-(1h-benzimidazol-2-yl)-n-[(e)-(3,4,5-trimethoxyphenyl)methyleneamino]benzamide

Structural Information

Molecular Formula
C24H22N4O4
SMILES
COC1=CC(=CC(=C1OC)OC)/C=N/NC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3
InChI
InChI=1S/C24H22N4O4/c1-30-20-12-15(13-21(31-2)22(20)32-3)14-25-28-24(29)17-9-5-4-8-16(17)23-26-18-10-6-7-11-19(18)27-23/h4-14H,1-3H3,(H,26,27)(H,28,29)/b25-14+
InChIKey
GSBUGWBGLFIYHH-AFUMVMLFSA-N
Compound name
2-(1H-benzimidazol-2-yl)-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

430.1641 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.171376 202.2
[M+Na]+ 453.153318 209.9
[M-H]- 429.156824 211.3
[M+NH4]+ 448.197923 211.1
[M+K]+ 469.127258 204.6
[M+H-H2O]+ 413.161360 190.8
[M+HCOO]- 475.162301 225.6
[M+CH3COO]- 489.177951 232.9
[M+Na-2H]- 451.138766 205.5
[M]+ 430.16355142 207.9
[M]- 430.16464858 207.9
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.