![3,9-Dipentylspiro[5.5]undecane-3-carbonitrile](/api/spectrum/HRNYtPRvbBF/structure.png?h=300&w=458 "3,9-Dipentylspiro[5.5]undecane-3-carbonitrile")
| SpectraBase Compound ID | 3SnMaH5PP73 |
|---|---|
| InChI | InChI=1S/C22H39N/c1-3-5-7-9-20-10-13-21(14-11-20)15-17-22(19-23,18-16-21)12-8-6-4-2/h20H,3-18H2,1-2H3 |
| InChIKey | PIACVBQVBPCHOS-UHFFFAOYSA-N |
| Mol Weight | 317.6 g/mol |
| Molecular Formula | C22H39N |
| Exact Mass | 317.30825 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HRNYtPRvbBF |
|---|---|
| Name | 3,9-Dipentylspiro[5.5]undecane-3-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H39N |
| InChI | InChI=1S/C22H39N/c1-3-5-7-9-20-10-13-21(14-11-20)15-17-22(19-23,18-16-21)12-8-6-4-2/h20H,3-18H2,1-2H3 |
| InChIKey | PIACVBQVBPCHOS-UHFFFAOYSA-N |
| Molecular Weight | 317.561 g/mol |
| SMILES | C1CC(CCC11CCC(CC1)CCCCC)(C#N)CCCCC |
| SPLASH | splash10-000i-0092000000-aa4aa7b273bde5c93854 |
| Source of Spectrum | U-1995-1325-15 |
| Wiley ID | 767185 |