| SpectraBase Spectrum ID |
D4J2lR6ozFP |
| Name |
3-Methyl-2,4,10-trioxatricyclo[3.3.1.1ALANAN3,7alanan]decane peak 1 |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
156.078644243 u |
| Formula |
C8H12O3 |
| InChI |
InChI=1S/C8H12O3/c1-8-9-5-2-6(10-8)4-7(3-5)11-8/h5-7H,2-4H2,1H3/t5-,6+,7-,8+ |
| InChIKey |
AYLSVZIJBMGQAQ-KVFPUHGPSA-N |
| Molecular Weight |
156.181 g/mol |
| SMILES |
C12(C)O[C@]3(C[C@@](O2)(C[C@@](O1)(C3)[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975715 |
![3-Methyl-2,4,10-trioxatricyclo[3.3.1.1ALANAN3,7alanan]decane peak 1](/api/spectrum/D4J2lR6ozFP/structure.png?h=300&w=458 "3-Methyl-2,4,10-trioxatricyclo[3.3.1.1ALANAN3,7alanan]decane peak 1")
