| SpectraBase Compound ID | DxzyceEO7te |
|---|---|
| InChI | InChI=1S/C8H6ClNO/c1-6-3-2-4-7(9)8(6)10-5-11/h2-4H,1H3 |
| InChIKey | FBTQQNYGMICJQZ-UHFFFAOYSA-N |
| Mol Weight | 167.59 g/mol |
| Molecular Formula | C8H6ClNO |
| Exact Mass | 167.013792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ChqMV8fu6Ko |
|---|---|
| Name | 1-chloro-2-isocyanato-3-methylbenzene |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H6ClNO |
| InChI | InChI=1S/C8H6ClNO/c1-6-3-2-4-7(9)8(6)10-5-11/h2-4H,1H3 |
| InChIKey | FBTQQNYGMICJQZ-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 167.595 g/mol |
| Source File Reference | MHKO4733 |