| SpectraBase Spectrum ID |
3jCwjJQfaLh |
| Name |
Diethyl 2-benzyloxymethyl-2-isopentylmalonate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.209324061 u |
| Formula |
C20H30O5 |
| InChI |
InChI=1S/C20H30O5/c1-5-24-18(21)20(13-12-16(3)4,19(22)25-6-2)15-23-14-17-10-8-7-9-11-17/h7-11,16H,5-6,12-15H2,1-4H3 |
| InChIKey |
MEAPCGWYCJTQKK-UHFFFAOYSA-N |
| Molecular Weight |
350.455 g/mol |
| SMILES |
C(C(=O)OCC)(C(=O)OCC)(CCC(C)C)COCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922265 |
