| SpectraBase Compound ID | 9yxRmHaihIs |
|---|---|
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3 |
| InChIKey | QJJDNZGPQDGNDX-UHFFFAOYSA-N |
| Mol Weight | 194.32 g/mol |
| Molecular Formula | C13H22O |
| Exact Mass | 194.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7GYGr0ljO5S |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H19OD3 |
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3 |
| InChIKey | QJJDNZGPQDGNDX-UHFFFAOYSA-N |
| Molecular Weight | 194.1665 |
| SMILES | C1(=C(C)CCCC1(C)C)CCC(C)=O |
| SPLASH | splash10-00fr-6900000000-d5995d1ca7c87cd01bc7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |