![2-[2-Methyl-3-(methoxycarbony)prop-2-en-1-yl]-4H-2,3-dihydrobenzopyran](/api/spectrum/BFkDle6eSMr/structure.png?h=300&w=458 "2-[2-Methyl-3-(methoxycarbony)prop-2-en-1-yl]-4H-2,3-dihydrobenzopyran")
| SpectraBase Compound ID | BcTaS3C65Ol |
|---|---|
| InChI | InChI=1S/C15H16O4/c1-10(8-15(17)18-2)7-11-9-13(16)12-5-3-4-6-14(12)19-11/h3-6,8,11H,7,9H2,1-2H3/b10-8+ |
| InChIKey | NCNZVHQUEZPCJI-CSKARUKUSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C15H16O4 |
| Exact Mass | 260.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BFkDle6eSMr |
|---|---|
| Name | 2-[2-Methyl-3-(methoxycarbony)prop-2-en-1-yl]-4H-2,3-dihydrobenzopyran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.104858991 u |
| Formula | C15H16O4 |
| InChI | InChI=1S/C15H16O4/c1-10(8-15(17)18-2)7-11-9-13(16)12-5-3-4-6-14(12)19-11/h3-6,8,11H,7,9H2,1-2H3/b10-8+ |
| InChIKey | NCNZVHQUEZPCJI-CSKARUKUSA-N |
| Molecular Weight | 260.289 g/mol |
| SMILES | C1(C2=C(C=CC=C2)OC(C1)C\C(=C\C(=O)OC)C)=O |