SpectraBase Spectrum ID |
2yCcNMSFIAa |
Name |
(-)-(2S,3S)-4-(1,3-dioxolan-2-yl)-2,3-dimethylbutan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
174.125594437 u |
Formula |
C9H18O3 |
InChI |
InChI=1S/C9H18O3/c1-7(8(2)6-10)5-9-11-3-4-12-9/h7-10H,3-6H2,1-2H3/t7-,8+/m0/s1 |
InChIKey |
PZUZXSRGEKDYGZ-JGVFFNPUSA-N |
Molecular Weight |
174.240 g/mol |
SMILES |
C1(C[C@@]([C@@](CO)(C)[H])(C)[H])OCCO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930476 |