| SpectraBase Spectrum ID |
3y8FvaiWuLo |
| Name |
3-([D6]dimethylsulfonio)-1,2-(13)C2-propionate |
| Comments |
Original formula: C3[13C]2H5D6ClO2S |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H11ClO2S |
| InChI |
InChI=1S/C5H10O2S.ClH/c1-8(2)4-3-5(6)7;/h3-4H2,1-2H3;1H/i1D3,2D3,3+1,5+1; |
| InChIKey |
RRUMKKGRKSSZKY-LCUYIZSJSA-N |
| Literature Reference DOI |
10.1002/cbic.201100416 |
| Molecular Weight |
178.675 g/mol |
| SMILES |
[Cl-].[13CH2]([13C](O)=O)C[S+](C([D])([D])[D])C([D])([D])[D] |
| SPLASH |
splash10-0gk9-9000000000-20ce2fb6c056eb6c561f |
| Source of Spectrum |
CBC-12-2276/SM3-3 |
| Synonyms |
(2-(carboxy-¹³C)ethyl-2-¹³C)bis(methyl-d3)sulfonium chloride |
| Wiley ID |
1786721 |
![3-([D6]dimethylsulfonio)-1,2-(13)C2-propionate](/api/spectrum/3y8FvaiWuLo/structure.png?h=300&w=458 "3-([D6]dimethylsulfonio)-1,2-(13)C2-propionate")
