| SpectraBase Compound ID | IY1tGFM2kv5 |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-7(2)12-6-10(12)8(3)5-11(12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3 |
| InChIKey | ITQLVLWNPZVVMT-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwOASmkVzbU |
|---|---|
| Name | 4-Thujen-2a-yl acetate |
| CAS Registry Number | 80489-61-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-7(2)12-6-10(12)8(3)5-11(12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3 |
| InChIKey | ITQLVLWNPZVVMT-UHFFFAOYSA-N |
| Literature Reference | E. Hethelyi, P. Tetenyi, Phytochem. 20, 1847 (1981). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |