| SpectraBase Compound ID | B2rD3W1sH2Z |
|---|---|
| InChI | InChI=1S/C16H23N/c1-12(17-11-13-5-6-13)9-14-7-8-15-3-2-4-16(15)10-14/h7-8,10,12-13,17H,2-6,9,11H2,1H3 |
| InChIKey | UQDOFLRVLHNNTC-UHFFFAOYSA-N |
| Mol Weight | 229.37 g/mol |
| Molecular Formula | C16H23N |
| Exact Mass | 229.18305 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lhn3x0ZtYQb |
|---|---|
| Name | 5-Apdi N-cyclopropylmethyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.183049745 u |
| Formula | C16H23N |
| InChI | InChI=1S/C16H23N/c1-12(17-11-13-5-6-13)9-14-7-8-15-3-2-4-16(15)10-14/h7-8,10,12-13,17H,2-6,9,11H2,1H3 |
| InChIKey | UQDOFLRVLHNNTC-UHFFFAOYSA-N |
| Molecular Weight | 229.367 g/mol |
| SMILES | C=12C(=CC(CC(NCC3CC3)C)=CC1)CCC2 |