CID 26618
Xipamide
Structural Information
- Molecular Formula
- C15H15ClN2O4S
- SMILES
- CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=C(C=C2O)Cl)S(=O)(=O)N
- InChI
- InChI=1S/C15H15ClN2O4S/c1-8-4-3-5-9(2)14(8)18-15(20)10-6-13(23(17,21)22)11(16)7-12(10)19/h3-7,19H,1-2H3,(H,18,20)(H2,17,21,22)
- InChIKey
- MTZBBNMLMNBNJL-UHFFFAOYSA-N
- Compound name
- 4-chloro-N-(2,6-dimethylphenyl)-2-hydroxy-5-sulfamoylbenzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 355.05138 | 177.1 |
[M+Na]+ | 377.03332 | 186.3 |
[M-H]- | 353.03682 | 183.1 |
[M+NH4]+ | 372.07792 | 190.3 |
[M+K]+ | 393.00726 | 180.2 |
[M+H-H2O]+ | 337.04136 | 171.1 |
[M+HCOO]- | 399.04230 | 189.9 |
[M+CH3COO]- | 413.05795 | 212.5 |
[M+Na-2H]- | 375.01877 | 177.7 |
[M]+ | 354.04355 | 180.9 |
[M]- | 354.04465 | 180.9 |