CID 218186

40294-18-6

Structural Information

Molecular Formula
C13H17N3O3
SMILES
CCOC1=C(C=C2C(=C1)NC(=N2)NC(=O)C)OCC
InChI
InChI=1S/C13H17N3O3/c1-4-18-11-6-9-10(7-12(11)19-5-2)16-13(15-9)14-8(3)17/h6-7H,4-5H2,1-3H3,(H2,14,15,16,17)
InChIKey
OFIYIIGQIAJUSV-UHFFFAOYSA-N
Compound name
N-(5,6-diethoxy-1H-benzimidazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.12698 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.13426 158.9
[M+Na]+ 286.11620 168.1
[M-H]- 262.11970 160.3
[M+NH4]+ 281.16080 175.4
[M+K]+ 302.09014 164.9
[M+H-H2O]+ 246.12424 151.4
[M+HCOO]- 308.12518 181.0
[M+CH3COO]- 322.14083 197.3
[M+Na-2H]- 284.10165 163.4
[M]+ 263.12643 163.7
[M]- 263.12753 163.7
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.