| SpectraBase Spectrum ID |
FQ9ZhRXmNQ7 |
| Name |
rel-(2R,4S,5R)-4-(2',5'-Dimethoxyphenyl)-2,5-dimethyl-1,3-dioxolane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.120509056 u |
| Formula |
C13H18O4 |
| InChI |
InChI=1S/C13H18O4/c1-8-13(17-9(2)16-8)11-7-10(14-3)5-6-12(11)15-4/h5-9,13H,1-4H3/t8-,9-,13-/m1/s1 |
| InChIKey |
JGVOFSHHEQPCOC-JRKPZEMJSA-N |
| Molecular Weight |
238.283 g/mol |
| SMILES |
C=1(OC)C=CC(=C([C@]2([C@](O[C@](O2)(C)[H])(C)[H])[H])C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846364 |
