| SpectraBase Compound ID | CsMdMdFlS0K |
|---|---|
| InChI | InChI=1S/C9H6N2O/c10-5-9-11-8-4-2-1-3-7(8)6-12-9/h1-4H,6H2 |
| InChIKey | CBZMNZWOPMCNGA-UHFFFAOYSA-N |
| Mol Weight | 158.16 g/mol |
| Molecular Formula | C9H6N2O |
| Exact Mass | 158.048013 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I1ooCKJaJz9 |
|---|---|
| Name | 4H-3,1-Benzoxazine-2-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6N2O |
| InChI | InChI=1S/C9H6N2O/c10-5-9-11-8-4-2-1-3-7(8)6-12-9/h1-4H,6H2 |
| InChIKey | CBZMNZWOPMCNGA-UHFFFAOYSA-N |
| Molecular Weight | 158.160 g/mol |
| SMILES | C1(=Nc2c(CO1)cccc2)C#N |
| SPLASH | splash10-0pb9-0900000000-d12a6492e3a128d68976 |
| Source of Spectrum | D1-1997-706-7 |
| Wiley ID | 834867 |