Cyclothiazide
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002302
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA002302 contains the MS mass spectrum of Cyclothiazide with the InChIkey BOCUKUHCLICSIY-UHFFFAOYSA-N.
Source: Cyclothiazide
Chemical Info
| InChI | InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20) |
|---|---|
| SMILES | Clc(c4)c(cc(c43)S(=O)(=O)NC(N3)C(C1)C(C=2)CC(C2)1)S(N)(=O)=O |
| InChI Key | BOCUKUHCLICSIY-UHFFFAOYSA-N |
| Molecular Formula | C14H16ClN3O4S2 |
| Exact Mass | 389.027 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | 5ea2d3e7-2bc7-409a-8f40-54612d3259a8 |
| Package id | msbnk-waters-wa002302 |
| Resource type | HTML |
| State | active |