| SpectraBase Compound ID | 6OEgp1MJQng |
|---|---|
| InChI | InChI=1S/C18H26ClN/c19-11-10-18-12-16-8-4-5-9-17(16)14-20(18)13-15-6-2-1-3-7-15/h1-3,6-7,16-18H,4-5,8-14H2 |
| InChIKey | ALASBQMPMKYRMW-UHFFFAOYSA-N |
| Mol Weight | 291.87 g/mol |
| Molecular Formula | C18H26ClN |
| Exact Mass | 291.175378 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3pHxRLdtrOV |
|---|---|
| Name | Isoquinoline, decahydro-3-(2-chloroethyl)-2-phenylmethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.175377541 u |
| Formula | C18H26ClN |
| InChI | InChI=1S/C18H26ClN/c19-11-10-18-12-16-8-4-5-9-17(16)14-20(18)13-15-6-2-1-3-7-15/h1-3,6-7,16-18H,4-5,8-14H2 |
| InChIKey | ALASBQMPMKYRMW-UHFFFAOYSA-N |
| SMILES | C1=CC=CC=C1CN1CC2CCCCC2CC1CCCl |