CID 10465564

634602-84-9

Structural Information

Molecular Formula
C10H10N2O3
SMILES
CCOC(=O)C1=CC2=C(C=C1)NC(=O)N2
InChI
InChI=1S/C10H10N2O3/c1-2-15-9(13)6-3-4-7-8(5-6)12-10(14)11-7/h3-5H,2H2,1H3,(H2,11,12,14)
InChIKey
OUTDXJNOFZUMGN-UHFFFAOYSA-N
Compound name
ethyl 2-oxo-1,3-dihydrobenzimidazole-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

206.06914 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.076416 141.4
[M+Na]+ 229.058358 151.9
[M-H]- 205.061864 141.6
[M+NH4]+ 224.102963 159.5
[M+K]+ 245.032298 147.8
[M+H-H2O]+ 189.066400 135.0
[M+HCOO]- 251.067341 162.1
[M+CH3COO]- 265.082991 178.8
[M+Na-2H]- 227.043806 147.1
[M]+ 206.06859142 143.0
[M]- 206.06968858 143.0
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