| SpectraBase Compound ID | 5HqE4X5MLDD |
|---|---|
| InChI | InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3/t7-,8+,9+/m0/s1 |
| InChIKey | YXNICIBZSREEPY-DJLDLDEBSA-N |
| Mol Weight | 154.21 g/mol |
| Molecular Formula | C9H14O2 |
| Exact Mass | 154.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6ZdT5Cn3vfR |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H12O2D2 |
| InChI | InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3/t7-,8+,9+/m0/s1 |
| InChIKey | YXNICIBZSREEPY-DJLDLDEBSA-N |
| Molecular Weight | 154.0990 |
| SMILES | C1[C@@]2(C[C@@](C[C@]2(OC(C)=O)[H])(C1)[H])[H] |
| SPLASH | splash10-00kf-9000000000-e168ae6c16494c5bafa8 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |