| SpectraBase Compound ID | LBmw6qo5Aus |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-9(13)10-2-3-11-12(8-10)16-7-5-14-4-6-15-11/h2-3,8H,4-7H2,1H3 |
| InChIKey | HVBJDRVPWMGWIG-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 47ikd2y71jz |
|---|---|
| Name | 4'-Acetyl-b9c3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-9(13)10-2-3-11-12(8-10)16-7-5-14-4-6-15-11/h2-3,8H,4-7H2,1H3 |
| InChIKey | HVBJDRVPWMGWIG-UHFFFAOYSA-N |
| Molecular Weight | 222.240 g/mol |
| SMILES | c12cc(C(=O)C)ccc2OCCOCCO1 |
| SPLASH | splash10-03di-4920000000-bb07704f98e545a7cf3f |
| Source of Spectrum | I-82-1717-4 |
| Synonyms | 4'-Acetyl-1,4,7-trioxabenzo[8,9-1',2']cyclononane |
| Wiley ID | 1551677 |