| SpectraBase Compound ID | IUJr5xXd91h |
|---|---|
| InChI | InChI=1S/C18H24O4/c1-3-4-5-6-7-10-21-13-14-11-18(19)22-17-12-15(20-2)8-9-16(14)17/h8-9,11-12H,3-7,10,13H2,1-2H3 |
| InChIKey | ZYCMATHHEJFPDI-UHFFFAOYSA-N |
| Mol Weight | 304.39 g/mol |
| Molecular Formula | C18H24O4 |
| Exact Mass | 304.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5SUQFtGcjoO |
|---|---|
| Name | 4-Heptyloxymethyl-7-methoxy-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.167459249 u |
| Formula | C18H24O4 |
| InChI | InChI=1S/C18H24O4/c1-3-4-5-6-7-10-21-13-14-11-18(19)22-17-12-15(20-2)8-9-16(14)17/h8-9,11-12H,3-7,10,13H2,1-2H3 |
| InChIKey | ZYCMATHHEJFPDI-UHFFFAOYSA-N |
| SMILES | C12=CC=C(C=C2OC(C=C1COCCCCCCC)=O)OC |