3-[(4-methylphenyl)sulfonyl]-1,2,3,4,5,6-hexahy...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01538
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML01538 contains the MS2 mass spectrum of...
Chemical Info
| InChI | InChI=1S/C18H20N2O3S/c1-13-5-7-16(8-6-13)24(22,23)19-10-14-9-15(12-19)17-3-2-4-18(21)20(17)11-14/h2-8,14-15H,9-12H2,1H3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(C2)C4=CC=CC(=O)N4C3 |
| InChI Key | IEMDPPNEUUFQGC-UHFFFAOYSA-N |
| Molecular Formula | C18H20N2O3S |
| Exact Mass | 344.119 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | fb4c7b51-4f04-4846-ae00-a3e11c2e9015 |
| Package id | msbnk-washington_state_univ-bml01538 |
| Resource type | HTML |
| State | active |