| SpectraBase Compound ID | LKqwdSx86Cr |
|---|---|
| InChI | InChI=1S/C26H35N/c1-3-5-11-18-27(19-12-6-4-2)20-17-26-24-15-9-7-13-22(24)21-23-14-8-10-16-25(23)26/h7-10,13-16,21H,3-6,11-12,17-20H2,1-2H3 |
| InChIKey | PIRUWIFCYOIPJE-UHFFFAOYSA-N |
| Mol Weight | 361.6 g/mol |
| Molecular Formula | C26H35N |
| Exact Mass | 361.27695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6KE5DfCcu7E |
|---|---|
| Name | 2C-H-Anth 2pe |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 361.276950131 u |
| Formula | C26H35N |
| InChI | InChI=1S/C26H35N/c1-3-5-11-18-27(19-12-6-4-2)20-17-26-24-15-9-7-13-22(24)21-23-14-8-10-16-25(23)26/h7-10,13-16,21H,3-6,11-12,17-20H2,1-2H3 |
| InChIKey | PIRUWIFCYOIPJE-UHFFFAOYSA-N |
| Molecular Weight | 361.573 g/mol |
| SMILES | C=1(C=2C(C=C3C1C=CC=C3)=CC=CC2)CCN(CCCCC)CCCCC |