| SpectraBase Compound ID | 7bkMhpGVlt |
|---|---|
| InChI | InChI=1S/C8H7NO/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | YDNLNVZZTACNJX-UHFFFAOYSA-N |
| Mol Weight | 133.15 g/mol |
| Molecular Formula | C8H7NO |
| Exact Mass | 133.052764 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8aXEVLNhzKW |
|---|---|
| Name | Benzyl isocyanate |
| CAS Registry Number | 3173-56-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO |
| InChI | InChI=1S/C8H7NO/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | YDNLNVZZTACNJX-UHFFFAOYSA-N |
| Molecular Weight | 133.150 g/mol |
| SMILES | c1cc(ccc1)CN=C=O |
| SPLASH | splash10-052f-9500000000-47fae5e319a965a6e746 |
| Source of Spectrum | NP-16-8917-0 |
| Synonyms | (Isocyanatomethyl)benzene Benzene, (isocyanatomethyl)- |
| Wiley ID | 1097358 |