CID 1088929

N-[2-(4-methoxyphenyl)-1h-benzimidazol-5-yl]acetamide

Structural Information

Molecular Formula
C16H15N3O2
SMILES
CC(=O)NC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C16H15N3O2/c1-10(20)17-12-5-8-14-15(9-12)19-16(18-14)11-3-6-13(21-2)7-4-11/h3-9H,1-2H3,(H,17,20)(H,18,19)
InChIKey
ZMDUSHIYBRBVDM-UHFFFAOYSA-N
Compound name
N-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

330
Patents

281.11642 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.123696 163.5
[M+Na]+ 304.105638 172.9
[M-H]- 280.109144 168.3
[M+NH4]+ 299.150243 178.8
[M+K]+ 320.079578 167.6
[M+H-H2O]+ 264.113680 154.9
[M+HCOO]- 326.114621 185.8
[M+CH3COO]- 340.130271 175.3
[M+Na-2H]- 302.091086 168.8
[M]+ 281.11587142 165.5
[M]- 281.11696858 165.5
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

patents stripe