CID 52204
3-allyl-2-amino-1-ethylbenzimidazole bromide
Structural Information
- Molecular Formula
- C12H16N3
- SMILES
- CCN1C2=CC=CC=C2[N+](=C1N)CC=C
- InChI
- InChI=1S/C12H15N3/c1-3-9-15-11-8-6-5-7-10(11)14(4-2)12(15)13/h3,5-8,13H,1,4,9H2,2H3/p+1
- InChIKey
- BQOVFDKHAWCJFY-UHFFFAOYSA-O
- Compound name
- 1-ethyl-3-prop-2-enylbenzimidazol-3-ium-2-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 203.14171 | 142.4 |
[M+Na]+ | 225.12365 | 157.8 |
[M+NH4]+ | 220.16825 | 151.8 |
[M+K]+ | 241.09759 | 152.9 |
[M-H]- | 201.12715 | 146.2 |
[M+Na-2H]- | 223.10910 | 149.5 |
[M]+ | 202.13388 | 145.9 |
[M]- | 202.13498 | 145.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.