SpectraBase Spectrum ID |
2qYpTi0af9J |
Name |
1,4-Dioxaspiro[4.5]dec-7-ene-7-carboxylic acid, 8-(2-methoxycarbonylethyl)-, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.125988358 u |
Formula |
C14H20O6 |
InChI |
InChI=1S/C14H20O6/c1-17-12(15)4-3-10-5-6-14(19-7-8-20-14)9-11(10)13(16)18-2/h3-9H2,1-2H3 |
InChIKey |
BMCIFKRZIQGNJY-UHFFFAOYSA-N |
SMILES |
C(CC=1CCC2(CC1C(=O)OC)OCCO2)C(OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982021 |