| SpectraBase Compound ID | 9dexu67VrKD |
|---|---|
| InChI | InChI=1S/C3H3NOS2/c5-3-4-2(6)1-7-3/h1H2,(H,4,5,6) |
| InChIKey | XTSVDOIDJDJMDS-UHFFFAOYSA-N |
| Mol Weight | 133.18 g/mol |
| Molecular Formula | C3H3NOS2 |
| Exact Mass | 132.965606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DMhv96nGLoU |
|---|---|
| Name | Isorhodanine |
| CAS Registry Number | 4303-29-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C3H3NOS2 |
| InChI | InChI=1S/C3H3NOS2/c5-3-4-2(6)1-7-3/h1H2,(H,4,5,6) |
| InChIKey | XTSVDOIDJDJMDS-UHFFFAOYSA-N |
| Instrument Name | Varian XL-200 |
| Literature Reference | N. Valls, V.M. Segarra, E. Alcade, J. Prakt. Chem. 327, 251 (1985). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |