| SpectraBase Compound ID | D9C44UwCa2R |
|---|---|
| InChI | InChI=1S/C18H22O4/c1-5-14(19)17-15(21-9-8-11(2)3)7-6-13-12(4)10-16(20)22-18(13)17/h6-7,10-11H,5,8-9H2,1-4H3 |
| InChIKey | HWQOJYABGYGGPE-UHFFFAOYSA-N |
| Mol Weight | 302.37 g/mol |
| Molecular Formula | C18H22O4 |
| Exact Mass | 302.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ArS99i6u0XB |
|---|---|
| Name | 7-(Isopentyloxy)-4-methyl-8-propionyl-2H-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.151809184 u |
| Formula | C18H22O4 |
| InChI | InChI=1S/C18H22O4/c1-5-14(19)17-15(21-9-8-11(2)3)7-6-13-12(4)10-16(20)22-18(13)17/h6-7,10-11H,5,8-9H2,1-4H3 |
| InChIKey | HWQOJYABGYGGPE-UHFFFAOYSA-N |
| SMILES | C12=C(C(=O)CC)C(OCCC(C)C)=CC=C2C(C)=CC(O1)=O |