| SpectraBase Compound ID | 82bldFvQG9R |
|---|---|
| InChI | InChI=1S/C8H12O/c1-6-3-4-8(9)5-7(6)2/h5-6H,3-4H2,1-2H3 |
| InChIKey | NDFYWJZFESRLBQ-UHFFFAOYSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DEC0Uh4ivGQ |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c1-6-3-4-8(9)5-7(6)2/h5-6H,3-4H2,1-2H3 |
| InChIKey | NDFYWJZFESRLBQ-UHFFFAOYSA-N |
| Molecular Weight | 124.0885 |
| SMILES | C1CC(=O)C=C(C1C)C |
| SPLASH | splash10-000t-9100000000-0a68c96378a1e88d181c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |