| SpectraBase Compound ID | JSSGXZfKAbg |
|---|---|
| InChI | InChI=1S/C7H5N3O2S/c8-4-13-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2 |
| InChIKey | QUWHIBBGKKRYFW-UHFFFAOYSA-N |
| Mol Weight | 195.2 g/mol |
| Molecular Formula | C7H5N3O2S |
| Exact Mass | 195.010248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5rc637vzrs5 |
|---|---|
| Name | Thiocyanic acid, 4-amino-3-nitrophenyl ester |
| CAS Registry Number | 54029-45-7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5N3O2S |
| InChI | InChI=1S/C7H5N3O2S/c8-4-13-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2 |
| InChIKey | QUWHIBBGKKRYFW-UHFFFAOYSA-N |
| Instrument Name | Bruker WH-90 |
| NMR Standard | DMSO-D6 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |