| SpectraBase Compound ID | Do7EwyIO45p |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-2-3-7-10-14-12(13)15-11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3 |
| InChIKey | VTPUCLSGHDEINJ-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HELyJMwz2M |
|---|---|
| Name | Carbonic acid, pentyl phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.109944372 u |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-2-3-7-10-14-12(13)15-11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3 |
| InChIKey | VTPUCLSGHDEINJ-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C1=CC=CC=C1OC(OCCCCC)=O |