| SpectraBase Compound ID | KRImcPY3iHK |
|---|---|
| InChI | InChI=1S/C9H6N2O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13/h2-4H,1H3 |
| InChIKey | DVKJHBMWWAPEIU-UHFFFAOYSA-N |
| Mol Weight | 174.16 g/mol |
| Molecular Formula | C9H6N2O2 |
| Exact Mass | 174.042927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6rZN2NN2KVc |
|---|---|
| Name | ISOCYANIC ACID, 4-METHYL-m-PHENYLENE ESTER |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 120C/10mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6N2O2 |
| InChI | InChI=1S/C9H6N2O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13/h2-4H,1H3 |
| InChIKey | DVKJHBMWWAPEIU-UHFFFAOYSA-N |
| Melting Point | 17-20C |
| Molecular Weight | 174.16 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |