| SpectraBase Compound ID | 4ZVBbFsCDdG |
|---|---|
| InChI | InChI=1S/C7H12O/c1-7(8)5-3-2-4-6-7/h3,5,8H,2,4,6H2,1H3 |
| InChIKey | LVUQVFWOWNKFRL-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2J0zDmdkAbq |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-7(8)5-3-2-4-6-7/h3,5,8H,2,4,6H2,1H3 |
| InChIKey | LVUQVFWOWNKFRL-UHFFFAOYSA-N |
| Molecular Weight | 112.0885 |
| SMILES | OC1(C)C=CCCC1 |
| SPLASH | splash10-004l-9000000000-2074a8fef4c8e59249e5 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |