| SpectraBase Compound ID | LZuyha5XIjR |
|---|---|
| InChI | InChI=1S/C12H9NO/c14-9-13-12-8-4-6-10-5-2-1-3-7-11(10)12/h1-8,12H |
| InChIKey | JGDMDYRRAHDXNL-UHFFFAOYSA-N |
| Mol Weight | 183.21 g/mol |
| Molecular Formula | C12H9NO |
| Exact Mass | 183.068414 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7WwcIcBlNyk |
|---|---|
| Name | 1H-Benzocyclohepten-1-yl isocyanate |
| Alternate Name(s) | 1-isocyanato-1H-benzo[a]cycloheptene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H9NO |
| InChI | InChI=1S/C12H9NO/c14-9-13-12-8-4-6-10-5-2-1-3-7-11(10)12/h1-8,12H |
| InChIKey | JGDMDYRRAHDXNL-UHFFFAOYSA-N |
| Molecular Weight | 183.210 g/mol |
| SMILES | C=12C(=CC=CC2N=C=O)C=CC=CC1 |
| SPLASH | splash10-002f-0900000000-06e56f768e8f79936b2e |
| Source of Spectrum | H-83-1531-19 |
| Wiley ID | 847160 |