| SpectraBase Compound ID | CSim3R6VmMi |
|---|---|
| InChI | InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2 |
| InChIKey | CGZZMOTZOONQIA-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 | 4gY1dqOxoVg |
|---|---|
| Name | Cycloheptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2 |
| InChIKey | CGZZMOTZOONQIA-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 112.172 g/mol |
| SMILES | C1(=O)CCCCCC1 |
| SPLASH | splash10-066u-9000000000-47c3fe36c17c03dadd16 |
| Source of Spectrum | SRH-2022-2584-0 |
| Wiley ID | 1824940 |