![()-(E)-2-[4-(benzyloxy)-2-methylbut-1-enyl]chroman](/api/spectrum/Jy5RtdjPwXE/structure.png?h=300&w=458 "()-(E)-2-[4-(benzyloxy)-2-methylbut-1-enyl]chroman")
| SpectraBase Compound ID | 7Wj5bhihO9j |
|---|---|
| InChI | InChI=1S/C21H24O2/c1-17(13-14-22-16-18-7-3-2-4-8-18)15-20-12-11-19-9-5-6-10-21(19)23-20/h2-10,15,20H,11-14,16H2,1H3 |
| InChIKey | USLMJKYWMUMFBB-UHFFFAOYSA-N |
| Mol Weight | 308.42 g/mol |
| Molecular Formula | C21H24O2 |
| Exact Mass | 308.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jy5RtdjPwXE |
|---|---|
| Name | ()-(E)-2-[4-(benzyloxy)-2-methylbut-1-enyl]chroman |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.177630011 u |
| Formula | C21H24O2 |
| InChI | InChI=1S/C21H24O2/c1-17(13-14-22-16-18-7-3-2-4-8-18)15-20-12-11-19-9-5-6-10-21(19)23-20/h2-10,15,20H,11-14,16H2,1H3 |
| InChIKey | USLMJKYWMUMFBB-UHFFFAOYSA-N |
| Molecular Weight | 308.421 g/mol |
| SMILES | C=12OC(CCC2=CC=CC1)C=C(CCOCC=1C=CC=CC1)C |