| SpectraBase Compound ID | 3aE2vsId7Ua |
|---|---|
| InChI | InChI=1S/C13H16N2S/c1-13(2,3)16-12-10-6-7-15-8-9(10)4-5-11(12)14/h4-8H,14H2,1-3H3 |
| InChIKey | AOVZXGSWZYLQJR-UHFFFAOYSA-N |
| Mol Weight | 232.34 g/mol |
| Molecular Formula | C13H16N2S |
| Exact Mass | 232.10342 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6de0cOnrp4h |
|---|---|
| Name | 6-Amino-5-(1-tert-butylthio)isoquinoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16N2S |
| InChI | InChI=1S/C13H16N2S/c1-13(2,3)16-12-10-6-7-15-8-9(10)4-5-11(12)14/h4-8H,14H2,1-3H3 |
| InChIKey | AOVZXGSWZYLQJR-UHFFFAOYSA-N |
| Molecular Weight | 232.345 g/mol |
| SMILES | Nc1c(SC(C)(C)C)c2c(cncc2)cc1 |
| SPLASH | splash10-004i-0900000000-a36bdf6338fd2e8e854d |
| Source of Spectrum | F-59-108-4ea |
| Wiley ID | 1676590 |