![2-Phenyl[2,4-13C]-1,3-dithiane](/api/spectrum/2aVN6Aw51ep/structure.png?h=300&w=458 "2-Phenyl[2,4-13C]-1,3-dithiane")
| SpectraBase Compound ID | DLRnvJ4VK3t |
|---|---|
| InChI | InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2/i7+1,10+1 |
| InChIKey | GXKPARDRBFURON-ZCIFZXMMSA-N |
| Mol Weight | 198.31 g/mol |
| Molecular Formula | C813C2H12S2 |
| Exact Mass | 198.044752 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2aVN6Aw51ep |
|---|---|
| Name | 2-Phenyl[2,4-13C]-1,3-dithiane |
| Comments | Original formula: C8[13C]2H12S2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H12S2 |
| InChI | InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2/i7+1,10+1 |
| InChIKey | GXKPARDRBFURON-ZCIFZXMMSA-N |
| Molecular Weight | 198.311 g/mol |
| SMILES | [13CH]1(SCC[13CH2]S1)c1ccccc1 |
| SPLASH | splash10-00dj-4900000000-208bcecf2d2494bf8cfe |
| Source of Spectrum | H-67-1079-0 |
| Wiley ID | 91382 |