| SpectraBase Compound ID | C3tTQle4qmw |
|---|---|
| InChI | InChI=1S/C22H27N/c1-3-14-23(15-4-2)16-13-22-20-11-7-5-9-18(20)17-19-10-6-8-12-21(19)22/h5-12,17H,3-4,13-16H2,1-2H3 |
| InChIKey | UQYSPDWAKMPIMX-UHFFFAOYSA-N |
| Mol Weight | 305.47 g/mol |
| Molecular Formula | C22H27N |
| Exact Mass | 305.21435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rH3r5hOlz4 |
|---|---|
| Name | 2C-H-Anth 2pr |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.214349873 u |
| Formula | C22H27N |
| InChI | InChI=1S/C22H27N/c1-3-14-23(15-4-2)16-13-22-20-11-7-5-9-18(20)17-19-10-6-8-12-21(19)22/h5-12,17H,3-4,13-16H2,1-2H3 |
| InChIKey | UQYSPDWAKMPIMX-UHFFFAOYSA-N |
| Molecular Weight | 305.465 g/mol |
| SMILES | C=1(C=2C(C=C3C1C=CC=C3)=CC=CC2)CCN(CCC)CCC |