| SpectraBase Compound ID | 4al5ZklSuPC |
|---|---|
| InChI | InChI=1S/C17H18O5/c1-13(21-17(18)19-2)12-20-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3 |
| InChIKey | JYILHSJAUSKCLJ-UHFFFAOYSA-N |
| Mol Weight | 302.33 g/mol |
| Molecular Formula | C17H18O5 |
| Exact Mass | 302.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 33pqzIcEx3L |
|---|---|
| Name | Carbonic acid methyl 1-(4-phenoxyphenoxy)propan-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.115423675 u |
| Formula | C17H18O5 |
| InChI | InChI=1S/C17H18O5/c1-13(21-17(18)19-2)12-20-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3 |
| InChIKey | JYILHSJAUSKCLJ-UHFFFAOYSA-N |
| SMILES | C(=O)(OC(COC=1C=CC(OC2=CC=CC=C2)=CC1)C)OC |