CID 71749264
7-hydroxy ondansetron
Structural Information
- Molecular Formula
- C18H19N3O2
- SMILES
- CC1=NC=CN1CC2CCC3=C(C2=O)C4=C(N3C)C=C(C=C4)O
- InChI
- InChI=1S/C18H19N3O2/c1-11-19-7-8-21(11)10-12-3-6-15-17(18(12)23)14-5-4-13(22)9-16(14)20(15)2/h4-5,7-9,12,22H,3,6,10H2,1-2H3
- InChIKey
- DTJUCZWBHDEFRB-UHFFFAOYSA-N
- Compound name
- 7-hydroxy-9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 310.15502 | 173.8 |
[M+Na]+ | 332.13696 | 187.9 |
[M+NH4]+ | 327.18156 | 181.4 |
[M+K]+ | 348.11090 | 184.5 |
[M-H]- | 308.14046 | 176.3 |
[M+Na-2H]- | 330.12241 | 178.1 |
[M]+ | 309.14719 | 176.5 |
[M]- | 309.14829 | 176.5 |
Literature stripe
Patent stripe
No patent data available for this compound.