SpectraBase Spectrum ID |
AheuDGra0qW |
Name |
6,6-Dimethyl-1-cis-propenyl-5,7-dioxaspiro[2.5]octane-4,8-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.089208927 u |
Formula |
C11H14O4 |
InChI |
InChI=1S/C11H14O4/c1-4-5-7-6-11(7)8(12)14-10(2,3)15-9(11)13/h4-5,7H,6H2,1-3H3/b5-4+/t7-/m0/s1 |
InChIKey |
RVTADUXPJCRCSF-KPJROHGDSA-N |
Molecular Weight |
210.229 g/mol |
SMILES |
C12(C(OC(OC2=O)(C)C)=O)[C@@](\C=C\C)(C1)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878765 |