| SpectraBase Compound ID | 1GS984wOrUz |
|---|---|
| InChI | InChI=1S/C9H5ClN2O/c10-7-2-1-6-5-13-9(4-11)12-8(6)3-7/h1-3H,5H2 |
| InChIKey | KNIPALVNARTSKV-UHFFFAOYSA-N |
| Mol Weight | 192.6 g/mol |
| Molecular Formula | C9H5ClN2O |
| Exact Mass | 192.00904 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JXiRxiaS1vS |
|---|---|
| Name | 7-Chloro-4H-3,1-benzoxazine-2-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5ClN2O |
| InChI | InChI=1S/C9H5ClN2O/c10-7-2-1-6-5-13-9(4-11)12-8(6)3-7/h1-3H,5H2 |
| InChIKey | KNIPALVNARTSKV-UHFFFAOYSA-N |
| Molecular Weight | 192.605 g/mol |
| SMILES | c12N=C(OCc2ccc(c1)Cl)C#N |
| SPLASH | splash10-052f-0900000000-9d9343bed45e9b9e91a5 |
| Source of Spectrum | D1-1997-706-7 |
| Wiley ID | 834866 |