SpectraBase Spectrum ID |
84e2x9ji053 |
Name |
2,2-Dimethyl-1,7-dioxaspiro[5.5]undec-4-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
182.130679818 u |
Formula |
C11H18O2 |
InChI |
InChI=1S/C11H18O2/c1-10(2)6-5-8-11(13-10)7-3-4-9-12-11/h5,8H,3-4,6-7,9H2,1-2H3 |
InChIKey |
WRNWMALYFRLOEW-UHFFFAOYSA-N |
Molecular Weight |
182.263 g/mol |
SMILES |
C12(OC(C)(C)CC=C2)OCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889821 |