| SpectraBase Compound ID | ERApvU16PfC |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2-4,7H2,1H3 |
| InChIKey | OGDYROFIIXDTQK-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 | EeCHDRcUqB9 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2-4,7H2,1H3 |
| InChIKey | OGDYROFIIXDTQK-UHFFFAOYSA-N |
| Molecular Weight | 112.0885 |
| SMILES | OCC#CCCCC |
| SPLASH | splash10-05c6-9000000000-5e9e9ff9aae544f6a3c0 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |