| SpectraBase Compound ID | FBfjLa5fwH7 |
|---|---|
| InChI | InChI=1S/C7H12O/c1-5-3-4-7(8)6(5)2/h5-6H,3-4H2,1-2H3 |
| InChIKey | NHHSVMBOTBXSFH-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 | LKDzuk99r7 |
|---|---|
| Name | CYCLOPENTANONE, 2,3-DIMETHYL-, cis=trans |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-5-3-4-7(8)6(5)2/h5-6H,3-4H2,1-2H3 |
| InChIKey | NHHSVMBOTBXSFH-UHFFFAOYSA-N |
| Instrument Name | CH5 |
| Molecular Weight | 112.0885 |
| SMILES | CC1C(C)C(=O)CC1 |
| SPLASH | splash10-0a4i-9000000000-3751bdd1da9d052508fe |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |