| SpectraBase Compound ID | 2oe7SLvzY8N |
|---|---|
| InChI | InChI=1S/C31H56O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-30-26-28-31(32)29-27-30/h26-29,32H,2-25H2,1H3 |
| InChIKey | SLPMCBISHLXZRA-UHFFFAOYSA-N |
| Mol Weight | 444.8 g/mol |
| Molecular Formula | C31H56O |
| Exact Mass | 444.433116 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4g0iAzzpCl8 |
|---|---|
| Name | Pentacosanylphenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 444.433116422 u |
| Formula | C31H56O |
| InChI | InChI=1S/C31H56O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-30-26-28-31(32)29-27-30/h26-29,32H,2-25H2,1H3 |
| InChIKey | SLPMCBISHLXZRA-UHFFFAOYSA-N |
| Molecular Weight | 444.788 g/mol |
| SMILES | C(CCCCCC1=CC=C(C=C1)O)CCCCCCCCCCCCCCCCCCC |