| SpectraBase Compound ID | 5vKe74LOXwN |
|---|---|
| InChI | InChI=1S/C22H33NO5S/c1-4-11-20(28-29(25,26)19-14-9-6-10-15-19)21(17(2)3)23-22(24)27-16-18-12-7-5-8-13-18/h4-5,7-8,12-13,17,19-21H,1,6,9-11,14-16H2,2-3H3,(H,23,24)/t20-,21-/m1/s1 |
| InChIKey | JRYDXPRXMKIJTR-NHCUHLMSSA-N |
| Mol Weight | 423.6 g/mol |
| Molecular Formula | C22H33NO5S |
| Exact Mass | 423.207944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J8EoER9vosM |
|---|---|
| Name | (R,R)-5-Benzyloxycarbonylamino-6-methylhept-1-en-4-cyclohexyl sulfonate |
| Alternate Name(s) | (1R)-1-((1R)-1-{[(benzyloxy)carbonyl]amino}-2-methylpropyl)-3-butenyl cyclohexanesulfonate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H33NO5S |
| InChI | InChI=1S/C22H33NO5S/c1-4-11-20(28-29(25,26)19-14-9-6-10-15-19)21(17(2)3)23-22(24)27-16-18-12-7-5-8-13-18/h4-5,7-8,12-13,17,19-21H,1,6,9-11,14-16H2,2-3H3,(H,23,24)/t20-,21-/m1/s1 |
| InChIKey | JRYDXPRXMKIJTR-NHCUHLMSSA-N |
| Molecular Weight | 423.568 g/mol |
| SMILES | N(C(=O)OCc1ccccc1)[C@@]([C@](OS(=O)(=O)C1CCCCC1)(CC=C)[H])(C(C)C)[H] |
| SPLASH | splash10-0f6x-9062000000-12e8dd44e332af49607a |
| Source of Spectrum | C5-2003-1866-10 |
| Wiley ID | 1615850 |