CID 3071004
1-(2-ethoxyethyl)-2-(4-methyl-1-piperazinyl)-1h-benzimidazole (e)-2-butenedioate (2:3)
Structural Information
- Molecular Formula
- C16H24N4O
- SMILES
- CCOCCN1C2=CC=CC=C2N=C1N3CCN(CC3)C
- InChI
- InChI=1S/C16H24N4O/c1-3-21-13-12-20-15-7-5-4-6-14(15)17-16(20)19-10-8-18(2)9-11-19/h4-7H,3,8-13H2,1-2H3
- InChIKey
- GARASDOODWWZMF-UHFFFAOYSA-N
- Compound name
- 1-(2-ethoxyethyl)-2-(4-methylpiperazin-1-yl)benzimidazole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 289.20228 | 171.1 |
[M+Na]+ | 311.18422 | 178.7 |
[M-H]- | 287.18772 | 172.8 |
[M+NH4]+ | 306.22882 | 184.1 |
[M+K]+ | 327.15816 | 173.9 |
[M+H-H2O]+ | 271.19226 | 160.2 |
[M+HCOO]- | 333.19320 | 187.1 |
[M+CH3COO]- | 347.20885 | 180.9 |
[M+Na-2H]- | 309.16967 | 173.6 |
[M]+ | 288.19445 | 172.0 |
[M]- | 288.19555 | 172.0 |