| SpectraBase Compound ID | Apdbq85TivC |
|---|---|
| InChI | InChI=1S/C15H19NO2/c1-2-3-4-5-9-12-16-15(17)18-13-14-10-7-6-8-11-14/h2,6-12H,1,3-5,13H2,(H,16,17)/b12-9+ |
| InChIKey | CTFJBRIJIYHBOU-FMIVXFBMSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C15H19NO2 |
| Exact Mass | 245.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GWPsNn5CH72 |
|---|---|
| Name | N-(Benzyloxycarbonyl)-3-hepta-1,6-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.141578854 u |
| Formula | C15H19NO2 |
| InChI | InChI=1S/C15H19NO2/c1-2-3-4-5-9-12-16-15(17)18-13-14-10-7-6-8-11-14/h2,6-12H,1,3-5,13H2,(H,16,17)/b12-9+ |
| InChIKey | CTFJBRIJIYHBOU-FMIVXFBMSA-N |
| Molecular Weight | 245.322 g/mol |
| SMILES | C(=O)(N\C=C\CCCC=C)OCC=1C=CC=CC1 |