Thiocyclam
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU382501
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU382501 contains the MS2 mass spectrum of Thiocyclam with the InChIkey DNVLJEWNNDHELH-UHFFFAOYSA-N.
Source: Thiocyclam
Chemical Info
| InChI | InChI=1S/C5H11NS3/c1-6(2)5-3-7-9-8-4-5/h5H,3-4H2,1-2H3 |
|---|---|
| SMILES | CN(C)C1CSSSC1 |
| InChI Key | DNVLJEWNNDHELH-UHFFFAOYSA-N |
| Molecular Formula | C5H11NS3 |
| Exact Mass | 181.005 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 4.0 International (CC BY 4.0) |
| Id | 35053bf2-17ca-48d3-a702-db45a1d883ac |
| Package id | msbnk-athens_univ-au382501 |
| Resource type | HTML |
| State | active |