| SpectraBase Compound ID | K5ZJUcLQqjX |
|---|---|
| InChI | InChI=1S/C13H16INOS/c14-9-12-7-4-8-15(12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2 |
| InChIKey | NCFWUEYPCHEBOE-UHFFFAOYSA-N |
| Mol Weight | 361.24 g/mol |
| Molecular Formula | C13H16INOS |
| Exact Mass | 360.99973 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KbYs46uId10 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16NOSI |
| InChI | InChI=1S/C13H16INOS/c14-9-12-7-4-8-15(12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2 |
| InChIKey | NCFWUEYPCHEBOE-UHFFFAOYSA-N |
| Molecular Weight | 360.9953 |
| SMILES | C(N1C(CI)CCC1)(SCc1ccccc1)=O |
| SPLASH | splash10-00ko-9230000000-32b5ff89f9c21fb628f7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |