| SpectraBase Compound ID | Kr5NPpheoqb |
|---|---|
| InChI | InChI=1S/C12H11NOS2/c1-15-12(16-2)10(8-13)11(14)9-6-4-3-5-7-9/h3-7H,1-2H3 |
| InChIKey | WPJMZDZXZRCHOP-UHFFFAOYSA-N |
| Mol Weight | 249.35 g/mol |
| Molecular Formula | C12H11NOS2 |
| Exact Mass | 249.028206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IPNbb0pMHBV |
|---|---|
| Name | BENZENEPROPANENITRILE, .ALPHA.-[BIS(METHYLTHIO)METHYLENE]-.BETA.-OXO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H11NOS2 |
| InChI | InChI=1S/C12H11NOS2/c1-15-12(16-2)10(8-13)11(14)9-6-4-3-5-7-9/h3-7H,1-2H3 |
| InChIKey | WPJMZDZXZRCHOP-UHFFFAOYSA-N |
| Instrument Name | BRUKER WP-200 |
| NMR Standard | TMS |
| Solvent | CDCL3 |