![1,3-Dithiane-2-[13C]Acid-carboxylic](/api/spectrum/9MSZAMmu4Yj/structure.png?h=300&w=458 "1,3-Dithiane-2-[13C]Acid-carboxylic")
| SpectraBase Compound ID | Fvzuti9rqKd |
|---|---|
| InChI | InChI=1S/C5H8O2S2/c6-4(7)5-8-2-1-3-9-5/h5H,1-3H2,(H,6,7)/i4+1 |
| InChIKey | BZBYEAWKJNCPLB-AZXPZELESA-N |
| Mol Weight | 165.23 g/mol |
| Molecular Formula | C413CH8O2S2 |
| Exact Mass | 164.999927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9MSZAMmu4Yj |
|---|---|
| Name | 1,3-Dithiane-2-[13C]Acid-carboxylic |
| Comments | Original formula: C4[13C]H8O2S2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8O2S2 |
| InChI | InChI=1S/C5H8O2S2/c6-4(7)5-8-2-1-3-9-5/h5H,1-3H2,(H,6,7)/i4+1 |
| InChIKey | BZBYEAWKJNCPLB-AZXPZELESA-N |
| Molecular Weight | 165.229 g/mol |
| SMILES | O[13C](C1SCCCS1)=O |
| SPLASH | splash10-014i-2900000000-a2c4ca2637b7f0ac0f21 |
| Source of Spectrum | H-92-1637-14 |
| Wiley ID | 1713894 |