![[3,3]Paracyclophan-2-one](/api/spectrum/1e9nfaRfIzL/structure.png?h=300&w=458 "[3,3]Paracyclophan-2-one")
| SpectraBase Compound ID | zNlabvhEbK |
|---|---|
| InChI | InChI=1S/C18H18O/c19-18-12-16-8-4-14(5-9-16)2-1-3-15-6-10-17(13-18)11-7-15/h4-11H,1-3,12-13H2 |
| InChIKey | KRMVEMKPEPMWGG-UHFFFAOYSA-N |
| Mol Weight | 250.34 g/mol |
| Molecular Formula | C18H18O |
| Exact Mass | 250.135765 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1e9nfaRfIzL |
|---|---|
| Name | [3,3]Paracyclophan-2-one |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H18O |
| InChI | InChI=1S/C18H18O/c19-18-12-16-8-4-14(5-9-16)2-1-3-15-6-10-17(13-18)11-7-15/h4-11H,1-3,12-13H2 |
| InChIKey | KRMVEMKPEPMWGG-UHFFFAOYSA-N |
| Molecular Weight | 250.341 g/mol |
| SMILES | C1(=O)Cc2ccc(cc2)CCCc2ccc(C1)cc2 |
| SPLASH | splash10-0uxr-1690000000-0656864a7818f881d2dd |
| Source of Spectrum | J-67-6135-1 |
| Wiley ID | 1570762 |