| SpectraBase Compound ID | 8X80tyO6eFF |
|---|---|
| InChI | InChI=1S/C28H39NO5S/c1-19(2)33-26(29-35(31,32)23-15-12-20(3)13-16-23)27(30)34-25-18-21(4)14-17-24(25)28(5,6)22-10-8-7-9-11-22/h7-13,15-16,19,21,24-26,29H,14,17-18H2,1-6H3/t21-,24-,25-,26-/m1/s1 |
| InChIKey | PCHYMDILRQEGLD-JLZPKONASA-N |
| Mol Weight | 501.7 g/mol |
| Molecular Formula | C28H39NO5S |
| Exact Mass | 501.254895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AoizQYXqkgt |
|---|---|
| Name | N-((2R)-N'-p-Toluenesulphonylisopropyloxyglycine)-8-(R)-phenylmenthyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H39NO5S |
| InChI | InChI=1S/C28H39NO5S/c1-19(2)33-26(29-35(31,32)23-15-12-20(3)13-16-23)27(30)34-25-18-21(4)14-17-24(25)28(5,6)22-10-8-7-9-11-22/h7-13,15-16,19,21,24-26,29H,14,17-18H2,1-6H3/t21-,24-,25-,26-/m1/s1 |
| InChIKey | PCHYMDILRQEGLD-JLZPKONASA-N |
| Molecular Weight | 501.682 g/mol |
| SMILES | N(S(c1ccc(cc1)C)(=O)=O)[C@@](C(O[C@]1([C@](C(c2ccccc2)(C)C)(CC[C@](C1)(C)[H])[H])[H])=O)(OC(C)C)[H] |
| SPLASH | splash10-066r-0920100000-6fac8c9cbd92f50ac9e9 |
| Source of Spectrum | KD-14-1164-4 |
| Wiley ID | 1636003 |