| SpectraBase Spectrum ID |
DxzPShqKns0 |
| Name |
(3,3-Dimethylcycloprop-1-en-1-yl)(2,2,5-trimethyl-1,3-dioxan-5-yl)methanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-11(2)6-9(11)10(14)13(5)7-15-12(3,4)16-8-13/h6,10,14H,7-8H2,1-5H3 |
| InChIKey |
MVPPDZOWZYXHHT-UHFFFAOYSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C1(C)(C)OCC(C(C=2C(C2)(C)C)O)(CO1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91079 |
