| SpectraBase Compound ID | LBqIGkWzktm |
|---|---|
| InChI | InChI=1S/C15H16ClN/c16-15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2 |
| InChIKey | ALYBQPZLRUVOGE-UHFFFAOYSA-N |
| Mol Weight | 245.75 g/mol |
| Molecular Formula | C15H16ClN |
| Exact Mass | 245.097127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IgrKzPrTk2C |
|---|---|
| Name | Phenethylamine, N-benzyl-p-chloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.097127219 u |
| Formula | C15H16ClN |
| InChI | InChI=1S/C15H16ClN/c16-15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2 |
| InChIKey | ALYBQPZLRUVOGE-UHFFFAOYSA-N |
| Molecular Weight | 245.753 g/mol |
| SMILES | C(CC1=CC=C(C=C1)Cl)NCC1=CC=CC=C1 |