| SpectraBase Spectrum ID |
Cqp6nHtt8oF |
| Name |
(-)-diasesamin-di-gamma-lactone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.068867403 u |
| Formula |
C20H14O8 |
| InChI |
InChI=1S/C20H14O8/c21-19-15-16(18(28-19)10-2-4-12-14(6-10)26-8-24-12)20(22)27-17(15)9-1-3-11-13(5-9)25-7-23-11/h1-6,15-18H,7-8H2 |
| InChIKey |
APOQDYUENSVQGT-UHFFFAOYSA-N |
| Molecular Weight |
382.324 g/mol |
| SMILES |
C=12OCOC1C=C(C=C2)C1C2C(=O)OC(C2C(=O)O1)C1=CC=2OCOC2C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936229 |
