| SpectraBase Compound ID | 1oex6JTFi2f |
|---|---|
| InChI | InChI=1S/C14H18N2O6S/c17-14(18)6-4-2-1-3-5-9-23-13-8-7-11(15(19)20)10-12(13)16(21)22/h7-8,10H,1-6,9H2,(H,17,18) |
| InChIKey | QINLGMVCHFLKEV-UHFFFAOYSA-N |
| Mol Weight | 342.37 g/mol |
| Molecular Formula | C14H18N2O6S |
| Exact Mass | 342.088557 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4QSfARZ4OPv |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C14H17N2O6SD |
| InChI | InChI=1S/C14H18N2O6S/c17-14(18)6-4-2-1-3-5-9-23-13-8-7-11(15(19)20)10-12(13)16(21)22/h7-8,10H,1-6,9H2,(H,17,18) |
| InChIKey | QINLGMVCHFLKEV-UHFFFAOYSA-N |
| Molecular Weight | 342.0881 |
| SMILES | OC(CCCCCCCSc1ccc(N(=O)=O)cc1N(=O)=O)=O |
| SPLASH | splash10-0a59-9400000000-303eb7b93956e0f9bdf8 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |