| SpectraBase Compound ID | 3ngzzs6h9zV |
|---|---|
| InChI | InChI=1S/C12H18O/c1-10(13)7-8-11-6-4-5-9-12(11,2)3/h6-8H,4-5,9H2,1-3H3/b8-7+ |
| InChIKey | JXVNWAUWOPLPEA-BQYQJAHWSA-N |
| Mol Weight | 178.27 g/mol |
| Molecular Formula | C12H18O |
| Exact Mass | 178.135765 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LU8Ri4B0HsH |
|---|---|
| Name | 3-BUTEN-2-ONE, 4-(6,6-DIMETHYL-1-CYCLOHEXEN-1-YL)- |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H18O |
| InChI | InChI=1S/C12H18O/c1-10(13)7-8-11-6-4-5-9-12(11,2)3/h6-8H,4-5,9H2,1-3H3/b8-7+ |
| InChIKey | JXVNWAUWOPLPEA-BQYQJAHWSA-N |
| Molecular Weight | 178.1353 |
| SMILES | C1=C(\C=C\C(=O)C)C(C)(C)CCC1 |
| SPLASH | splash10-006x-9700000000-390c0ab13e7b472aded1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |