CID 210192

N-(2-(1-benzimidazolyl)ethyl)acetamide oxalate

Structural Information

Molecular Formula
C11H13N3O
SMILES
CC(=O)NCCN1C=NC2=CC=CC=C21
InChI
InChI=1S/C11H13N3O/c1-9(15)12-6-7-14-8-13-10-4-2-3-5-11(10)14/h2-5,8H,6-7H2,1H3,(H,12,15)
InChIKey
GVWLXPDDBZUMPZ-UHFFFAOYSA-N
Compound name
N-[2-(benzimidazol-1-yl)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

203.10587 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.11315 143.4
[M+Na]+ 226.09509 152.5
[M-H]- 202.09859 145.8
[M+NH4]+ 221.13969 162.6
[M+K]+ 242.06903 149.4
[M+H-H2O]+ 186.10313 135.7
[M+HCOO]- 248.10407 167.3
[M+CH3COO]- 262.11972 187.1
[M+Na-2H]- 224.08054 150.7
[M]+ 203.10532 145.8
[M]- 203.10642 145.8
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