| SpectraBase Compound ID | H5sY9fOcoSC |
|---|---|
| InChI | InChI=1S/C25H38N2O/c26-22-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-24-20-21-25(23-28)27-24/h2,4,8,10,20-21,23,27H,1,3,5-7,9,11-19H2 |
| InChIKey | ZAQUCOXNPKIVGV-UHFFFAOYSA-N |
| Mol Weight | 382.6 g/mol |
| Molecular Formula | C25H38N2O |
| Exact Mass | 382.298414 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5YKWu8Pmj6t |
|---|---|
| Name | Mycalenitrile-6 |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38N2O |
| InChI | InChI=1S/C25H38N2O/c26-22-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-24-20-21-25(23-28)27-24/h2,4,8,10,20-21,23,27H,1,3,5-7,9,11-19H2 |
| InChIKey | ZAQUCOXNPKIVGV-UHFFFAOYSA-N |
| Instrument Name | Hewlett-Packard HP6980 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np900444m |
| Molecular Weight | 382.592 g/mol |
| Reported Formula | C25H38N2O |
| SMILES | [nH]1c(ccc1CCCCCCCCCCC=CCC=CCCCCC#N)C=O |
| SPLASH | splash10-008d-9512000000-6b745ef7783147ded9c0 |
| Source of Spectrum | G4-72-1934-6 |
| Wiley ID | 1872087 |