![3-[5-[[2-Isopropyl-5-methylcyclohexyl]oxy]pentyl]thiazolidine](/api/spectrum/KZAwxU1VuNj/structure.png?h=300&w=458 "3-[5-[[2-Isopropyl-5-methylcyclohexyl]oxy]pentyl]thiazolidine")
| SpectraBase Compound ID | AkEtdBuAj1t |
|---|---|
| InChI | InChI=1S/C18H35NOS/c1-15(2)17-8-7-16(3)13-18(17)20-11-6-4-5-9-19-10-12-21-14-19/h15-18H,4-14H2,1-3H3 |
| InChIKey | RWTQFBWCUCVJQF-UHFFFAOYSA-N |
| Mol Weight | 313.5 g/mol |
| Molecular Formula | C18H35NOS |
| Exact Mass | 313.243936 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KZAwxU1VuNj |
|---|---|
| Name | 3-[5-[[2-Isopropyl-5-methylcyclohexyl]oxy]pentyl]thiazolidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.243935924 u |
| Formula | C18H35NOS |
| InChI | InChI=1S/C18H35NOS/c1-15(2)17-8-7-16(3)13-18(17)20-11-6-4-5-9-19-10-12-21-14-19/h15-18H,4-14H2,1-3H3 |
| InChIKey | RWTQFBWCUCVJQF-UHFFFAOYSA-N |
| Molecular Weight | 313.544 g/mol |
| SMILES | C1C(C(CCC1C)C(C)C)OCCCCCN1CSCC1 |