| SpectraBase Compound ID | G8DVv1tjrVE |
|---|---|
| InChI | InChI=1S/C19H22O4/c1-4-11-22-17(20)19(2,3)18(21)23-13-14-9-10-15-7-5-6-8-16(15)12-14/h5-10,12H,4,11,13H2,1-3H3 |
| InChIKey | XMMQASJHRMLRBX-UHFFFAOYSA-N |
| Mol Weight | 314.38 g/mol |
| Molecular Formula | C19H22O4 |
| Exact Mass | 314.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1prXmBMxLb0 |
|---|---|
| Name | Dimethylmalonic acid, 2-naphthylmethyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.151809184 u |
| Formula | C19H22O4 |
| InChI | InChI=1S/C19H22O4/c1-4-11-22-17(20)19(2,3)18(21)23-13-14-9-10-15-7-5-6-8-16(15)12-14/h5-10,12H,4,11,13H2,1-3H3 |
| InChIKey | XMMQASJHRMLRBX-UHFFFAOYSA-N |
| Molecular Weight | 314.381 g/mol |
| SMILES | C1=CC2=CC(COC(C(C(OCCC)=O)(C)C)=O)=CC=C2C=C1 |