| SpectraBase Compound ID | 3JYrt5eH5wg |
|---|---|
| InChI | InChI=1S/C31H64/c1-4-7-10-13-16-19-22-25-28-31(29-26-23-20-17-14-11-8-5-2)30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3 |
| InChIKey | BCWYKEQUGMQGAP-UHFFFAOYSA-N |
| Mol Weight | 436.9 g/mol |
| Molecular Formula | C31H64 |
| Exact Mass | 436.500802 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJYBhUGKVZ9 |
|---|---|
| Name | Heneicosane, 11-decyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 436.500802061 u |
| Formula | C31H64 |
| InChI | InChI=1S/C31H64/c1-4-7-10-13-16-19-22-25-28-31(29-26-23-20-17-14-11-8-5-2)30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3 |
| InChIKey | BCWYKEQUGMQGAP-UHFFFAOYSA-N |
| Molecular Weight | 436.853 g/mol |
| SMILES | C(C(CCCCCCCCCC)CCCCCCCCCC)CCCCCCCCC |