| SpectraBase Compound ID | 4v5a5MzsKSw |
|---|---|
| InChI | InChI=1S/C22H27N/c1-2-3-14-21-17-16-20-13-7-8-15-22(20)23(21)18-9-12-19-10-5-4-6-11-19/h4-13,15,21H,2-3,14,16-18H2,1H3/b12-9+ |
| InChIKey | UYZKNTSYJXUJOS-FMIVXFBMSA-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 | FyKKmG8dkAB |
|---|---|
| Name | 2-Butyl-1-cinnamyl-1,2,3,4-tetrahydroquinoline |
| 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/c1-2-3-14-21-17-16-20-13-7-8-15-22(20)23(21)18-9-12-19-10-5-4-6-11-19/h4-13,15,21H,2-3,14,16-18H2,1H3/b12-9+ |
| InChIKey | UYZKNTSYJXUJOS-FMIVXFBMSA-N |
| Molecular Weight | 305.465 g/mol |
| SMILES | C1=CC=C2CCC(CCCC)N(C\C=C\C3=CC=CC=C3)C2=C1 |