| SpectraBase Compound ID | Cj0ayijbtqL |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-3-2-4(8)6(10)7(11)5(3)9/h3-4,6-8,10-11H,2H2,1H3 |
| InChIKey | FQFXYFNHFVFHPV-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BLYZkSxEgyi |
|---|---|
| Name | 2,3,4-Trihydroxy-6-methylcyclohexanone |
| Alternate Name(s) | 2,3,4-trihydroxy-6-methyl-1-cyclohexanone Cyclohexanone, 2,3,4-trihydroxy-6-methyl-, [2S-(2.alpha.,3.beta.,4.beta.,6.alpha.)]- 2,3,4-trihydroxy-6-methyl-cyclohexanone 2,3,4-trihydroxy-6-methylcyclohexan-1-one 6-Methyl-2,3,4-tris(oxidanyl)cyclohexan-1-one |
| CAS Registry Number | 106750-01-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-3-2-4(8)6(10)7(11)5(3)9/h3-4,6-8,10-11H,2H2,1H3 |
| InChIKey | FQFXYFNHFVFHPV-UHFFFAOYSA-N |
| Molecular Weight | 160.169 g/mol |
| SMILES | OC1CC(C(C(C1O)O)=O)C |
| SPLASH | splash10-00dr-9100000000-b437f274e711d2decf9c |
| Source of Spectrum | U-1993-248-6 |
| Wiley ID | 764705 |