| SpectraBase Compound ID | BMrKeuQe8JA |
|---|---|
| InChI | InChI=1S/C12H15NOS/c1-8(14)11-7-9-5-3-4-6-10(9)12(13-11)15-2/h7H,3-6H2,1-2H3 |
| InChIKey | GVUDWUFDPRDPFA-UHFFFAOYSA-N |
| Mol Weight | 221.32 g/mol |
| Molecular Formula | C12H15NOS |
| Exact Mass | 221.087435 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FFKuxEtKuAW |
|---|---|
| Name | 1-(1-Methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)ethanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15NOS |
| InChI | InChI=1S/C12H15NOS/c1-8(14)11-7-9-5-3-4-6-10(9)12(13-11)15-2/h7H,3-6H2,1-2H3 |
| InChIKey | GVUDWUFDPRDPFA-UHFFFAOYSA-N |
| Molecular Weight | 221.318 g/mol |
| SMILES | C(C)(c1nc(c2c(c1)CCCC2)SC)=O |
| SPLASH | splash10-0079-3940000000-5b1c0f5d00c9429f8c55 |
| Source of Spectrum | KC-61-8155-3 |
| Wiley ID | 1630221 |