| SpectraBase Compound ID | 9VbgIU23Lwz |
|---|---|
| InChI | InChI=1S/C27H42O3/c1-4-7-11-20-26(30-27(28)22-8-5-2)21-15-10-14-19-25(16-6-3)29-23-24-17-12-9-13-18-24/h5-6,9,12-13,17-18,25-26H,2-4,7-8,10-11,14-16,19-23H2,1H3/t25-,26+/m0/s1 |
| InChIKey | FJFOHJWSMPZNGU-IZZNHLLZSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C27H42O3 |
| Exact Mass | 414.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F96ji7065UP |
|---|---|
| Name | (4R,10R)-4-(Benzyloxy)pentadec-1-en-10-yl pent-4-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.313395209 u |
| Formula | C27H42O3 |
| InChI | InChI=1S/C27H42O3/c1-4-7-11-20-26(30-27(28)22-8-5-2)21-15-10-14-19-25(16-6-3)29-23-24-17-12-9-13-18-24/h5-6,9,12-13,17-18,25-26H,2-4,7-8,10-11,14-16,19-23H2,1H3/t25-,26+/m0/s1 |
| InChIKey | FJFOHJWSMPZNGU-IZZNHLLZSA-N |
| Molecular Weight | 414.630 g/mol |
| SMILES | C(=O)(O[C@@](CCCCC[C@@](OCC1=CC=CC=C1)(CC=C)[H])(CCCCC)[H])CCC=C |