| SpectraBase Compound ID | LW4pOtMWFlD |
|---|---|
| InChI | InChI=1S/C11H6O3/c12-7-1-3-8-9(4-2-7)11(14)6-5-10(8)13/h1-6H |
| InChIKey | HGNHRPJEEMWOBO-UHFFFAOYSA-N |
| Mol Weight | 186.17 g/mol |
| Molecular Formula | C11H6O3 |
| Exact Mass | 186.031694 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9lDWvutX5Eh |
|---|---|
| Name | benzocycloheptene-1,4,7-trione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H6O3 |
| InChI | InChI=1S/C11H6O3/c12-7-1-3-8-9(4-2-7)11(14)6-5-10(8)13/h1-6H |
| InChIKey | HGNHRPJEEMWOBO-UHFFFAOYSA-N |
| Molecular Weight | 186.166 g/mol |
| SMILES | C12=C(C=CC(C=C2)=O)C(=O)C=CC1=O |
| SPLASH | splash10-0zgi-0900000000-bfcffa7b41f4491d6df8 |
| Source of Spectrum | KC-0-2176-3 |
| Synonyms | benzo[7]annulene-1,4,7-trione |
| Wiley ID | 820943 |