3-[(4-methylphenyl)sulfonyl]-1,2,3,4,5,6-hexahy...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80355
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML80355 contains the MS 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 |
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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 |
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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 | 1242904c-88e5-4ed3-970e-20409c7e26d9 |
Package id | msbnk-washington_state_univ-bml80355 |
Resource type | HTML |
State | active |