| SpectraBase Compound ID | JLPRRcoOOvr |
|---|---|
| InChI | InChI=1S/C9H12O3/c1-9(2,3)5-12-7-4-6(10)8(7)11/h4H,5H2,1-3H3 |
| InChIKey | YHMAKYLSOWNPFJ-UHFFFAOYSA-N |
| Mol Weight | 168.19 g/mol |
| Molecular Formula | C9H12O3 |
| Exact Mass | 168.078644 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1vkJYMaxn8I |
|---|---|
| Name | 3-Neopentoxy-3-cyclobuten-1,2-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O3 |
| InChI | InChI=1S/C9H12O3/c1-9(2,3)5-12-7-4-6(10)8(7)11/h4H,5H2,1-3H3 |
| InChIKey | YHMAKYLSOWNPFJ-UHFFFAOYSA-N |
| Molecular Weight | 168.192 g/mol |
| SMILES | C1(C(C(=C1)OCC(C)(C)C)=O)=O |
| SPLASH | splash10-0006-9000000000-baeae8d20a1b4d6a23d9 |
| Source of Spectrum | SO-0-241-6 |
| Synonyms | 3-(neopentyloxy)-3-cyclobutene-1,2-dione |
| Wiley ID | 1541326 |