| SpectraBase Compound ID | IGxVf2J5Nry |
|---|---|
| InChI | InChI=1S/C19H19NS/c1-19(2,3)18-17(21-15-10-5-4-6-11-15)16-12-8-7-9-14(16)13-20-18/h4-13H,1-3H3 |
| InChIKey | CYBHMPRLOMDXIP-UHFFFAOYSA-N |
| Mol Weight | 293.43 g/mol |
| Molecular Formula | C19H19NS |
| Exact Mass | 293.123821 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JvmNjSrs1hS |
|---|---|
| Name | 3-tert-Butyl-4-(phenylthio)isoquinoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H19NS |
| InChI | InChI=1S/C19H19NS/c1-19(2,3)18-17(21-15-10-5-4-6-11-15)16-12-8-7-9-14(16)13-20-18/h4-13H,1-3H3 |
| InChIKey | CYBHMPRLOMDXIP-UHFFFAOYSA-N |
| Molecular Weight | 293.428 g/mol |
| SMILES | c1(c(ncc2c1cccc2)C(C)(C)C)Sc1ccccc1 |
| SPLASH | splash10-014i-0090000000-c9c8e2de36c6b6357360 |
| Source of Spectrum | F4-43-1224-17 |
| Wiley ID | 1675542 |