| SpectraBase Compound ID | 5EdG17YaMkv |
|---|---|
| InChI | InChI=1S/C25H50O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(2)26/h3-24H2,1-2H3 |
| InChIKey | CDTIEPBCRWXMBD-UHFFFAOYSA-N |
| Mol Weight | 366.7 g/mol |
| Molecular Formula | C25H50O |
| Exact Mass | 366.386166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69lNA2fjdUH |
|---|---|
| Name | 2-Pentacosanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.386166229 u |
| Formula | C25H50O |
| InChI | InChI=1S/C25H50O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(2)26/h3-24H2,1-2H3 |
| InChIKey | CDTIEPBCRWXMBD-UHFFFAOYSA-N |
| Molecular Weight | 366.674 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCC(C)=O |