CID 51056299
882865-01-2
Structural Information
- Molecular Formula
- C13H17N3O4
- SMILES
- CCOC(=O)NC1=NC2=C(N1)C=C(C=C2)OCCOC
- InChI
- InChI=1S/C13H17N3O4/c1-3-19-13(17)16-12-14-10-5-4-9(8-11(10)15-12)20-7-6-18-2/h4-5,8H,3,6-7H2,1-2H3,(H2,14,15,16,17)
- InChIKey
- DQSOLQWOBDKREY-UHFFFAOYSA-N
- Compound name
- ethyl N-[6-(2-methoxyethoxy)-1H-benzimidazol-2-yl]carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 280.12920 | 161.1 |
[M+Na]+ | 302.11114 | 169.2 |
[M-H]- | 278.11464 | 162.1 |
[M+NH4]+ | 297.15574 | 176.5 |
[M+K]+ | 318.08508 | 166.7 |
[M+H-H2O]+ | 262.11918 | 153.1 |
[M+HCOO]- | 324.12012 | 183.4 |
[M+CH3COO]- | 338.13577 | 197.5 |
[M+Na-2H]- | 300.09659 | 166.5 |
[M]+ | 279.12137 | 166.8 |
[M]- | 279.12247 | 166.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.