![2-[(3-formyl-4-keto-6-phenyl-5,6-dihydrothiopyran-2-yl)thio]acetic acid ethyl ester](/api/spectrum/HV6nNGOKM09/structure.png?h=300&w=458 "2-[(3-formyl-4-keto-6-phenyl-5,6-dihydrothiopyran-2-yl)thio]acetic acid ethyl ester")
| SpectraBase Compound ID | GhrG0RyKD1A |
|---|---|
| InChI | InChI=1S/C16H16O4S2/c1-2-20-15(19)10-21-16-12(9-17)13(18)8-14(22-16)11-6-4-3-5-7-11/h3-7,9,14H,2,8,10H2,1H3 |
| InChIKey | QPOIKAIXCALYLD-UHFFFAOYSA-N |
| Mol Weight | 336.42 g/mol |
| Molecular Formula | C16H16O4S2 |
| Exact Mass | 336.049001 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HV6nNGOKM09 |
|---|---|
| Name | ACETIC ACID, [(5-FORMYL-3,4-DIHYDRO-4-OXO-2-PHENYL-2H-THIOPYRAN-6-YL)THIO]- ETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H16O4S2 |
| InChI | InChI=1S/C16H16O4S2/c1-2-20-15(19)10-21-16-12(9-17)13(18)8-14(22-16)11-6-4-3-5-7-11/h3-7,9,14H,2,8,10H2,1H3 |
| InChIKey | QPOIKAIXCALYLD-UHFFFAOYSA-N |
| Instrument Name | BRUKER ARX-300 |
| NMR Standard | TMS |
| Solvent | CDCl3 |