| SpectraBase Spectrum ID |
5a8qPUlAIxv |
| Name |
(2S)-1-o-p-Methoxycinnamoylglycerol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.099773610 u |
| Formula |
C13H16O5 |
| InChI |
InChI=1S/C13H16O5/c1-17-12-5-2-10(3-6-12)4-7-13(16)18-9-11(15)8-14/h2-7,11,14-15H,8-9H2,1H3/b7-4+/t11-/m0/s1 |
| InChIKey |
TWNMUIOZHQVLGC-ZPMKCOPCSA-N |
| Molecular Weight |
252.266 g/mol |
| SMILES |
C(\C=C\C1=CC=C(C=C1)OC)(=O)OC[C@@](O)(CO)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899868 |
