| SpectraBase Compound ID | IEaosYfgJK2 |
|---|---|
| InChI | InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i1+1 |
| InChIKey | YXFVVABEGXRONW-OUBTZVSYSA-N |
| Mol Weight | 93.13 g/mol |
| Molecular Formula | C613CH8 |
| Exact Mass | 93.065955 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7OpckMjqxt6 |
|---|---|
| Name | Methylbenzene |
| Comments | Original formula: C6[13C]H8 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H8 |
| InChI | InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i1+1 |
| InChIKey | YXFVVABEGXRONW-OUBTZVSYSA-N |
| Molecular Weight | 93.133 g/mol |
| SMILES | [13CH3]c1ccccc1 |
| SPLASH | splash10-0006-9000000000-20818ed4d799e161b533 |
| Source of Spectrum | H-66-331-0 |
| Wiley ID | 1117651 |