| SpectraBase Compound ID | 7ATydDQg9Xs |
|---|---|
| InChI | InChI=1S/C6H12O/c1-5-2-3-6(5)4-7/h5-7H,2-4H2,1H3/t5-,6+/m1/s1 |
| InChIKey | XKJMEEWZNIOOBO-RITPCOANSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JEIiFT47GjA |
|---|---|
| Name | C6 H12 O |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-5-2-3-6(5)4-7/h5-7H,2-4H2,1H3/t5-,6+/m1/s1 |
| InChIKey | XKJMEEWZNIOOBO-RITPCOANSA-N |
| Molecular Weight | 100.161 g/mol |
| SMILES | OC[C@]1([C@@](CC1)(C)[H])[H] |
| SPLASH | splash10-0a4l-9000000000-63398f9b701436a4c804 |
| Source of Spectrum | J-65-7142-7 |
| Wiley ID | 1533508 |