| SpectraBase Spectrum ID |
2aTPc6ZeBP3 |
| Name |
(Anti)-methyl 3-(2,5-dimethoxyphenyl)-3-(4-methoxyphenyl)-2-methylpropanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.162373868 u |
| Formula |
C20H24O5 |
| InChI |
InChI=1S/C20H24O5/c1-13(20(21)25-5)19(14-6-8-15(22-2)9-7-14)17-12-16(23-3)10-11-18(17)24-4/h6-13,19H,1-5H3/t13-,19+/m1/s1 |
| InChIKey |
NUBFOZLYABAGLB-YJYMSZOUSA-N |
| Molecular Weight |
344.407 g/mol |
| SMILES |
C=1C=C([C@]([C@@](C)(C(OC)=O)[H])(C2=CC(=CC=C2OC)OC)[H])C=CC1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907208 |
