| SpectraBase Compound ID | IXLjpOQyTTm |
|---|---|
| InChI | InChI=1S/C12H12O2S2/c1-14-10-4-2-9(3-5-10)11(13)8-12-15-6-7-16-12/h2-5,8H,6-7H2,1H3 |
| InChIKey | GOVRIUKFEFDCHQ-UHFFFAOYSA-N |
| Mol Weight | 252.35 g/mol |
| Molecular Formula | C12H12O2S2 |
| Exact Mass | 252.027872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H6mwY4Gu4nV |
|---|---|
| Name | BENZENEPROPANAL, .ALPHA.-[BIS(METHYLTHIO)METHYLENE]-.BETA.-OXO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H12O2S2 |
| InChI | InChI=1S/C12H12O2S2/c1-14-10-4-2-9(3-5-10)11(13)8-12-15-6-7-16-12/h2-5,8H,6-7H2,1H3 |
| InChIKey | GOVRIUKFEFDCHQ-UHFFFAOYSA-N |
| Instrument Name | BRUKER WP-200 |
| NMR Standard | TMS |
| Solvent | CDCL3 |