![2-Phenyl-[2-13C]-1,3-dithiane](/api/spectrum/K6nzuwRgXRt/structure.png?h=300&w=458 "2-Phenyl-[2-13C]-1,3-dithiane")
| SpectraBase Compound ID | 3Cmceuqg4zd |
|---|---|
| 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/i5+1 |
| InChIKey | GXKPARDRBFURON-HOSYLAQJSA-N |
| Mol Weight | 197.32 g/mol |
| Molecular Formula | C913CH12S2 |
| Exact Mass | 197.041398 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K6nzuwRgXRt |
|---|---|
| Name | 2-Phenyl-[2-13C]-1,3-dithiane |
| Comments | Original formula: C9[13C]H12S2 |
| 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/i5+1 |
| InChIKey | GXKPARDRBFURON-HOSYLAQJSA-N |
| Molecular Weight | 197.318 g/mol |
| SMILES | [13cH]1ccccc1C1SCCCS1 |
| SPLASH | splash10-00dj-0900000000-aeb247cab5beec36acbd |
| Source of Spectrum | H-67-1079-0 |
| Wiley ID | 91381 |