| SpectraBase Compound ID | 6gns6cjex1W |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-6(10)7(12-5)8(11)9(2,3)4/h7H,1-5H3 |
| InChIKey | BHDVFBIYHSLHKH-UHFFFAOYSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7MEVrqPw6fu |
|---|---|
| Name | 5,5-Dimethyl-3-methoxy-hexa-2,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c1-6(10)7(12-5)8(11)9(2,3)4/h7H,1-5H3 |
| InChIKey | BHDVFBIYHSLHKH-UHFFFAOYSA-N |
| Molecular Weight | 172.224 g/mol |
| SMILES | CC(C(C(C(C)(C)C)=O)OC)=O |
| SPLASH | splash10-0a4i-9000000000-fcc517ade260207e59c1 |
| Source of Spectrum | JX-2015-6-3513 |
| Synonyms | 3-Methoxy-5,5-dimethylhexane-2,4-dione |
| Wiley ID | 1728593 |