SpectraBase Spectrum ID |
HFPzcCj7uSC |
Name |
Ethyl 9-oxo-1,4-dioxaspiro[4.5]decane-6-carboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.099773610 u |
Formula |
C11H16O5 |
InChI |
InChI=1S/C11H16O5/c1-2-14-10(13)9-4-3-8(12)7-11(9)15-5-6-16-11/h9H,2-7H2,1H3 |
InChIKey |
NJYAZYDZINTXDV-UHFFFAOYSA-N |
Molecular Weight |
228.244 g/mol |
SMILES |
C12(C(C(=O)OCC)CCC(C2)=O)OCCO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900255 |