| SpectraBase Compound ID | JOq1CcMGTHv |
|---|---|
| InChI | InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H |
| InChIKey | NXHSSIGRWJENBH-UHFFFAOYSA-N |
| Mol Weight | 180.18 g/mol |
| Molecular Formula | C7H4N2O2S |
| Exact Mass | 179.999349 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8B1LtsZCDwI |
|---|---|
| Name | isothiocyanic acid, p-nitrophenyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4N2O2S |
| InChI | InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H |
| InChIKey | NXHSSIGRWJENBH-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 19236M |
| Solvent | CDCl3 |