| SpectraBase Compound ID | GPPpG4Cj955 |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-12(2)15-8-6-13(3)10-17(15)23-19(20)14-7-9-16(21-4)18(11-14)22-5/h7,9,11-13,15,17H,6,8,10H2,1-5H3 |
| InChIKey | VLHOGGRSYLACGN-UHFFFAOYSA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C19H28O4 |
| Exact Mass | 320.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4uxj9CW6Ybb |
|---|---|
| Name | 2-Isopropyl-5-methylcyclohexyl 3,4-dimethoxybenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.198759378 u |
| Formula | C19H28O4 |
| InChI | InChI=1S/C19H28O4/c1-12(2)15-8-6-13(3)10-17(15)23-19(20)14-7-9-16(21-4)18(11-14)22-5/h7,9,11-13,15,17H,6,8,10H2,1-5H3 |
| InChIKey | VLHOGGRSYLACGN-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(C=1C=C(C(=CC1)OC)OC)(=O)OC1C(CCC(C1)C)C(C)C |