| SpectraBase Compound ID | 9OXUac5TKie |
|---|---|
| InChI | InChI=1S/C11H12N2O3S/c14-8(12-9-10(15)13-11(9)17)6-16-7-4-2-1-3-5-7/h1-5,9,11,17H,6H2,(H,12,14)(H,13,15)/t9-,11-/m0/s1 |
| InChIKey | WTWJKCUOGFFOAJ-ONGXEEELSA-N |
| Mol Weight | 252.29 g/mol |
| Molecular Formula | C11H12N2O3S |
| Exact Mass | 252.056863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5gTAAlLuJha |
|---|---|
| Name | 3-PHENOXYACETAMIDO-4-MERCAPTO-2-AZETIDINONE |
| CAS Registry Number | 61534-76-7 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H12N2O3S |
| InChI | InChI=1S/C11H12N2O3S/c14-8(12-9-10(15)13-11(9)17)6-16-7-4-2-1-3-5-7/h1-5,9,11,17H,6H2,(H,12,14)(H,13,15)/t9-,11-/m0/s1 |
| InChIKey | WTWJKCUOGFFOAJ-ONGXEEELSA-N |
| Literature Reference Author | S.WOLFE,S.RO,Z.SHI |
| Literature Reference Citation | CAN.J.CHEM.,79,1259(2001) |
| Literature Reference DOI | 10.1139/cjc-79-8-1259 |
| Molecular Weight | 252.288 g/mol |
| Solvent | DMSO-D6 |