| SpectraBase Compound ID | 2vVAncOCZdV |
|---|---|
| InChI | InChI=1S/C24H22O4/c1-15-9-11-19(13-17(15)3)27-23(25)21-7-5-6-8-22(21)24(26)28-20-12-10-16(2)18(4)14-20/h5-14H,1-4H3 |
| InChIKey | TTXITVDNXZKVOK-UHFFFAOYSA-N |
| Mol Weight | 374.44 g/mol |
| Molecular Formula | C24H22O4 |
| Exact Mass | 374.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1wYiuBLMg5s |
|---|---|
| Name | Phthalic acid, di(3,4-dimethylphenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.151809184 u |
| Formula | C24H22O4 |
| InChI | InChI=1S/C24H22O4/c1-15-9-11-19(13-17(15)3)27-23(25)21-7-5-6-8-22(21)24(26)28-20-12-10-16(2)18(4)14-20/h5-14H,1-4H3 |
| InChIKey | TTXITVDNXZKVOK-UHFFFAOYSA-N |
| Molecular Weight | 374.436 g/mol |
| SMILES | CC1=CC=C(C=C1C)OC(C1=C(C(OC2=CC=C(C(=C2)C)C)=O)C=CC=C1)=O |