| SpectraBase Spectrum ID |
Bbq5jTx33P4 |
| Name |
4-(Isopropylidenedioxy)-2(S)-methylbutan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
160.109944372 u |
| Formula |
C8H16O3 |
| InChI |
InChI=1S/C8H16O3/c1-6(4-9)7-5-10-8(2,3)11-7/h6-7,9H,4-5H2,1-3H3/t6-,7?/m0/s1 |
| InChIKey |
ZEXONBYTDOABDB-PKPIPKONSA-N |
| Molecular Weight |
160.213 g/mol |
| SMILES |
C1(OC(CO1)[C@](CO)(C)[H])(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906132 |
