| SpectraBase Compound ID | ECm2Qyo44xV |
|---|---|
| InChI | InChI=1S/C16H19NO2S/c1-18-15-8-11-5-6-17-14(9-12-4-3-7-20-12)13(11)10-16(15)19-2/h3-4,7-8,10,14,17H,5-6,9H2,1-2H3 |
| InChIKey | CDXYNOFCFNFSRK-UHFFFAOYSA-N |
| Mol Weight | 289.39 g/mol |
| Molecular Formula | C16H19NO2S |
| Exact Mass | 289.11365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EXS5g8K0nor |
|---|---|
| Name | 6,7-Dimethoxy-1-(2-thenyl)-1,2,3,4-tetrahydroisoquinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.113650028 u |
| Formula | C16H19NO2S |
| InChI | InChI=1S/C16H19NO2S/c1-18-15-8-11-5-6-17-14(9-12-4-3-7-20-12)13(11)10-16(15)19-2/h3-4,7-8,10,14,17H,5-6,9H2,1-2H3 |
| InChIKey | CDXYNOFCFNFSRK-UHFFFAOYSA-N |
| Molecular Weight | 289.393 g/mol |
| SMILES | C=12C(CC=3SC=CC3)NCCC1C=C(OC)C(=C2)OC |