| SpectraBase Compound ID | ErEd2yPOCrU |
|---|---|
| InChI | InChI=1S/C11H8ClNO4/c12-11-9(6-14)17-8-4-2-1-3-7(8)13(11)5-10(15)16/h1-4,6H,5H2,(H,15,16) |
| InChIKey | CQZJCNQGPUOCAA-UHFFFAOYSA-N |
| Mol Weight | 253.64 g/mol |
| Molecular Formula | C11H8ClNO4 |
| Exact Mass | 253.014185 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9EGgqmXeaPe |
|---|---|
| Name | 3-Chloro-N-acetic acid-1,4-benzoxazine-2-carbaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H8ClNO4 |
| InChI | InChI=1S/C11H8ClNO4/c12-11-9(6-14)17-8-4-2-1-3-7(8)13(11)5-10(15)16/h1-4,6H,5H2,(H,15,16) |
| InChIKey | CQZJCNQGPUOCAA-UHFFFAOYSA-N |
| Molecular Weight | 253.641 g/mol |
| SMILES | OC(CN1C(=C(C=O)Oc2c1cccc2)Cl)=O |
| SPLASH | splash10-0a4s-1490000000-b7257508f65ef68d56d4 |
| Source of Spectrum | Y1-37-40-2 |
| Wiley ID | 1527279 |