| SpectraBase Compound ID | AbdqNDiblLw |
|---|---|
| InChI | InChI=1S/C7H12O/c1-7-4-2-3-5-8-6-7/h2,4,7H,3,5-6H2,1H3 |
| InChIKey | UDTDRTUAALKRMI-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 | 2jcSpg4y5Yr |
|---|---|
| Name | 3-Methyl-2,3,6,7-tetrahydrooxepin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-7-4-2-3-5-8-6-7/h2,4,7H,3,5-6H2,1H3 |
| InChIKey | UDTDRTUAALKRMI-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C1OCCC=CC1C |
| SPLASH | splash10-014i-9000000000-8fcd4b8d810d4a745159 |
| Source of Spectrum | HC-23-376-0 |
| Wiley ID | 1123499 |