![(1S,2R,2ïS)-2-[2ï-(N-HYDROXYCARBAMOYLMETHYLENE)-3ï-PHENYLPROPIONYLAMINO]-CYCLOHEXANE-1-CARBOXYLATE_ACID](/api/spectrum/2CI9A8lXJSl/structure.png?h=300&w=458 "(1S,2R,2ïS)-2-[2ï-(N-HYDROXYCARBAMOYLMETHYLENE)-3ï-PHENYLPROPIONYLAMINO]-CYCLOHEXANE-1-CARBOXYLATE_ACID")
| SpectraBase Compound ID | 4k7MsRk8xlh |
|---|---|
| InChI | InChI=1S/C18H24N2O5/c21-16(20-25)11-13(10-12-6-2-1-3-7-12)17(22)19-15-9-5-4-8-14(15)18(23)24/h1-3,6-7,13-15,25H,4-5,8-11H2,(H,19,22)(H,20,21)(H,23,24)/t13-,14-,15+/m1/s1 |
| InChIKey | JEXMRIPRLZUHAH-KFWWJZLASA-N |
| Mol Weight | 348.4 g/mol |
| Molecular Formula | C18H24N2O5 |
| Exact Mass | 348.168522 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2CI9A8lXJSl |
|---|---|
| Name | (1S,2R,2ïS)-2-[2ï-(N-HYDROXYCARBAMOYLMETHYLENE)-3ï-PHENYLPROPIONYLAMINO]-CYCLOHEXANE-1-CARBOXYLATE_ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H23N2O5 |
| InChI | InChI=1S/C18H24N2O5/c21-16(20-25)11-13(10-12-6-2-1-3-7-12)17(22)19-15-9-5-4-8-14(15)18(23)24/h1-3,6-7,13-15,25H,4-5,8-11H2,(H,19,22)(H,20,21)(H,23,24)/t13-,14-,15+/m1/s1 |
| InChIKey | JEXMRIPRLZUHAH-KFWWJZLASA-N |
| Literature Reference Author | S.G.DAVIES,D.J.DIXON |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2629(1998) |
| Literature Reference DOI | 10.1039/a804660c |
| Molecular Weight | 347.391 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ6296 |