![(2RS,3SR)-N-Ethyl-N'-{3-Hydroxy-2-methyl-3-[1-(phenylthio)cyclohexyl]propyl}urea](/api/spectrum/Fwar0oD3dcM/structure.png?h=300&w=458 "(2RS,3SR)-N-Ethyl-N'-{3-Hydroxy-2-methyl-3-[1-(phenylthio)cyclohexyl]propyl}urea")
| SpectraBase Compound ID | 7mVZVwX6QN7 |
|---|---|
| InChI | InChI=1S/C19H30N2O2S/c1-3-20-18(23)21-14-15(2)17(22)19(12-8-5-9-13-19)24-16-10-6-4-7-11-16/h4,6-7,10-11,15,17,22H,3,5,8-9,12-14H2,1-2H3,(H2,20,21,23)/t15-,17+/m1/s1 |
| InChIKey | WKDQIXJPVIBUIH-WBVHZDCISA-N |
| Mol Weight | 350.52 g/mol |
| Molecular Formula | C19H30N2O2S |
| Exact Mass | 350.202799 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fwar0oD3dcM |
|---|---|
| Name | (2RS,3SR)-N-Ethyl-N'-{3-Hydroxy-2-methyl-3-[1-(phenylthio)cyclohexyl]propyl}urea |
| Alternate Name(s) | N-ethyl-N'-{3-hydroxy-2-methyl-3-[1-(phenylsulfanyl)cyclohexyl]propyl}urea |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H30N2O2S |
| InChI | InChI=1S/C19H30N2O2S/c1-3-20-18(23)21-14-15(2)17(22)19(12-8-5-9-13-19)24-16-10-6-4-7-11-16/h4,6-7,10-11,15,17,22H,3,5,8-9,12-14H2,1-2H3,(H2,20,21,23)/t15-,17+/m1/s1 |
| InChIKey | WKDQIXJPVIBUIH-WBVHZDCISA-N |
| Molecular Weight | 350.521 g/mol |
| SMILES | N(C(=O)NCC)C[C@]([C@@](C1(Sc2ccccc2)CCCCC1)(O)[H])(C)[H] |
| SPLASH | splash10-0a59-5900000000-2f9e4348d63527140329 |
| Source of Spectrum | KC-1993-1647-18 |
| Wiley ID | 778343 |