| SpectraBase Compound ID | AtyjDrQtamF |
|---|---|
| InChI | InChI=1S/C10H18O2/c1-10(2,3)8-4-5-9(11)12-7-6-8/h8H,4-7H2,1-3H3 |
| InChIKey | XFKCBMHHCWKGMQ-UHFFFAOYSA-N |
| Mol Weight | 170.25 g/mol |
| Molecular Formula | C10H18O2 |
| Exact Mass | 170.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IPWug7opnjL |
|---|---|
| Name | 2-Oxepanone, 5-(1,1-dimethylethyl)- |
| CAS Registry Number | 34680-83-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H18O2 |
| InChI | InChI=1S/C10H18O2/c1-10(2,3)8-4-5-9(11)12-7-6-8/h8H,4-7H2,1-3H3 |
| InChIKey | XFKCBMHHCWKGMQ-UHFFFAOYSA-N |
| Molecular Weight | 170.252 g/mol |
| SMILES | C1CC(C(C)(C)C)CCC(O1)=O |
| SPLASH | splash10-0a4i-9100000000-0bdef9fd88d4eee63f69 |
| Synonyms | 5-tert-Butyl-2-oxepanone 5-tert-Butyloxepan-2-one |
| Wiley ID | 1487310 |