| SpectraBase Compound ID | Bi2VU8ogKDH |
|---|---|
| InChI | InChI=1S/C23H40O3/c1-20(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-21-22(24)18-19-26-23(21)25/h18-20,24H,3-17H2,1-2H3 |
| InChIKey | XEKYYIHOWASTHE-UHFFFAOYSA-N |
| Mol Weight | 364.6 g/mol |
| Molecular Formula | C23H40O3 |
| Exact Mass | 364.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 15dvTREm5Ef |
|---|---|
| Name | 3-Isooctadecanyl-4-hydroxy-.alpha.-pyrone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 364.297745145 u |
| Formula | C23H40O3 |
| InChI | InChI=1S/C23H40O3/c1-20(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-21-22(24)18-19-26-23(21)25/h18-20,24H,3-17H2,1-2H3 |
| InChIKey | XEKYYIHOWASTHE-UHFFFAOYSA-N |
| Molecular Weight | 364.570 g/mol |
| SMILES | C1(C(=C(C=CO1)O)CCCCCCCCCCCCCCCC(C)C)=O |