| SpectraBase Compound ID | AR0icr7h4c2 |
|---|---|
| InChI | InChI=1S/C18H24O5/c1-12(2)17(19)22-10-6-7-14-8-9-15(16(11-14)21-5)23-18(20)13(3)4/h6-9,11-13H,10H2,1-5H3/b7-6- |
| InChIKey | RWETVSSIRIMMBD-SREVYHEPSA-N |
| Mol Weight | 320.39 g/mol |
| Molecular Formula | C18H24O5 |
| Exact Mass | 320.162374 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5LtVehpbTCy |
|---|---|
| Name | (Z)-3-(4-(Isobutyryloxy)-3-methoxyphenyl)allyl isobutyrate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.162373868 u |
| Formula | C18H24O5 |
| InChI | InChI=1S/C18H24O5/c1-12(2)17(19)22-10-6-7-14-8-9-15(16(11-14)21-5)23-18(20)13(3)4/h6-9,11-13H,10H2,1-5H3/b7-6- |
| InChIKey | RWETVSSIRIMMBD-SREVYHEPSA-N |
| Molecular Weight | 320.385 g/mol |
| SMILES | C(C(C)C)(=O)OC\C=C/C1=CC(=C(C=C1)OC(C(C)C)=O)OC |