| SpectraBase Compound ID | Is85TG1M3Vl |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-6-4-7(6)5-8/h2-3,6-8H,4-5H2,1H3/b3-2- |
| InChIKey | ULYCIQVQLSONHF-IHWYPQMZSA-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 | JVF3jIVjvxh |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-6-4-7(6)5-8/h2-3,6-8H,4-5H2,1H3/b3-2- |
| InChIKey | ULYCIQVQLSONHF-IHWYPQMZSA-N |
| Molecular Weight | 112.0885 |
| SMILES | OCC1C(\C=C/C)C1 |
| SPLASH | splash10-017l-9000000000-55b396d42dc62f9bddb5 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |