CID 218184

N-(4,5,6-trimethoxy-1h-benzimidazol-2-yl)acetamide

Structural Information

Molecular Formula
C12H15N3O4
SMILES
CC(=O)NC1=NC2=C(C(=C(C=C2N1)OC)OC)OC
InChI
InChI=1S/C12H15N3O4/c1-6(16)13-12-14-7-5-8(17-2)10(18-3)11(19-4)9(7)15-12/h5H,1-4H3,(H2,13,14,15,16)
InChIKey
GGHGQILGZNBGQA-UHFFFAOYSA-N
Compound name
N-(4,5,6-trimethoxy-1H-benzimidazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.10626 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.113536 157.0
[M+Na]+ 288.095478 167.3
[M-H]- 264.098984 159.0
[M+NH4]+ 283.140083 173.5
[M+K]+ 304.069418 165.0
[M+H-H2O]+ 248.103520 149.8
[M+HCOO]- 310.104461 179.5
[M+CH3COO]- 324.120111 197.8
[M+Na-2H]- 286.080926 161.4
[M]+ 265.10571142 163.3
[M]- 265.10680858 163.3
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

patents stripe