| SpectraBase Spectrum ID |
5eKWPlWEl9D |
| Name |
2-Hydroxycineole, isobutyrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.172544630 u |
| Formula |
C14H24O3 |
| InChI |
InChI=1S/C14H24O3/c1-9(2)12(15)16-11-8-10-6-7-14(11,5)17-13(10,3)4/h9-11H,6-8H2,1-5H3/t10-,11-,14+/m1/s1 |
| InChIKey |
WDYRMTKOGHYOOI-GYSYKLTISA-N |
| Molecular Weight |
240.343 g/mol |
| SMILES |
[C@@]1(C[C@]2(CC[C@]1(C)OC2(C)C)[H])(OC(C(C)C)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943718 |
