| SpectraBase Compound ID | 8PifPVuwLGu |
|---|---|
| InChI | InChI=1S/C12H22O6S/c1-5-19(15,16)9(2)6-10(7-11(13)17-3)8-12(14)18-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | VHPXPVQWXBNZDM-UHFFFAOYSA-N |
| Mol Weight | 294.36 g/mol |
| Molecular Formula | C12H22O6S |
| Exact Mass | 294.11371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTSATi8oXD3 |
|---|---|
| Name | 3-(2-Ethylsulfonyl-propyl)-pentanedioic acid, dimethyl ester |
| CAS Registry Number | 116007-16-0 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H22O6S |
| InChI | InChI=1S/C12H22O6S/c1-5-19(15,16)9(2)6-10(7-11(13)17-3)8-12(14)18-4/h9-10H,5-8H2,1-4H3 |
| InChIKey | VHPXPVQWXBNZDM-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-270 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |