| SpectraBase Compound ID | wDOdo3ypn9 |
|---|---|
| InChI | InChI=1S/C30H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-26-27-30(28-32)31-29/h3-4,6-7,9-10,12-13,15-16,26-28,31H,2,5,8,11,14,17-25H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15- |
| InChIKey | OSPMUJDBRMIEIH-JLNKQSITSA-N |
| Mol Weight | 435.7 g/mol |
| Molecular Formula | C30H45NO |
| Exact Mass | 435.350115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L6sD6BnkJE1 |
|---|---|
| Name | Mycalazal 2 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 435.350115072 u |
| Formula | C30H45NO |
| InChI | InChI=1S/C30H45NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-26-27-30(28-32)31-29/h3-4,6-7,9-10,12-13,15-16,26-28,31H,2,5,8,11,14,17-25H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15- |
| InChIKey | OSPMUJDBRMIEIH-JLNKQSITSA-N |
| Molecular Weight | 435.696 g/mol |
| SMILES | C=1(NC(=CC1)CCCCCCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)C=O |