| SpectraBase Compound ID | IUHeHR54rGt |
|---|---|
| InChI | InChI=1S/C10H6N2O/c11-7-10-12-9-4-2-1-3-8(9)5-6-13-10/h1-6H |
| InChIKey | UCCKBAPZOKCNRY-UHFFFAOYSA-N |
| Mol Weight | 170.17 g/mol |
| Molecular Formula | C10H6N2O |
| Exact Mass | 170.048013 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FeV3OpsW2Ki |
|---|---|
| Name | 3,1-Benzoxazepine-2-carbonitrile |
| CAS Registry Number | 18457-80-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H6N2O |
| InChI | InChI=1S/C10H6N2O/c11-7-10-12-9-4-2-1-3-8(9)5-6-13-10/h1-6H |
| InChIKey | UCCKBAPZOKCNRY-UHFFFAOYSA-N |
| Molecular Weight | 170.171 g/mol |
| SMILES | c1ccc2c(c1)C=COC(C#N)=N2 |
| SPLASH | splash10-0296-6900000000-99a2feada5407872e14a |
| Source of Spectrum | S-23-129-1 |
| Wiley ID | 1166776 |