| SpectraBase Compound ID | DoxbjHup7Rn |
|---|---|
| InChI | InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3 |
| InChIKey | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
| Mol Weight | 108.14 g/mol |
| Molecular Formula | C7H8O |
| Exact Mass | 108.057515 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 56pbtfW1mS7 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5D3O |
| InChI | InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3 |
| InChIKey | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
| Molecular Weight | 108.0573 |
| SMILES | Oc1ccccc1C |
| SPLASH | splash10-03e9-9400000000-1ffef2b51972e9e3cc22 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |