| SpectraBase Compound ID | AQGd1pNxrMI |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-13-18-14-9-10-15-19(18)16-11-12-17-20(21)22/h9-10,14-15H,2-8,11-13,16-17H2,1H3,(H,21,22) |
| InChIKey | QCCHJTAMACNSEY-UHFFFAOYSA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DviLrcrClBM |
|---|---|
| Name | Dodecahydroserpentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.240230268 u |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-13-18-14-9-10-15-19(18)16-11-12-17-20(21)22/h9-10,14-15H,2-8,11-13,16-17H2,1H3,(H,21,22) |
| InChIKey | QCCHJTAMACNSEY-UHFFFAOYSA-N |
| Molecular Weight | 304.474 g/mol |
| SMILES | C(=O)(O)CCCCC=1C(CCCCCCCCC)=CC=CC1 |