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]+ 431.17138 202.2
[M+Na]+ 453.15332 209.9
[M-H]- 429.15682 211.3
[M+NH4]+ 448.19792 211.1
[M+K]+ 469.12726 204.6
[M+H-H2O]+ 413.16136 190.8
[M+HCOO]- 475.16230 225.6
[M+CH3COO]- 489.17795 232.9
[M+Na-2H]- 451.13877 205.5
[M]+ 430.16355 207.9
[M]- 430.16465 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.