SpectraBase Spectrum ID |
CQM3OED488w |
Name |
2H-Pyran-3-ol, tetrahydro-6-methoxy-2-methyl-, [2R-(2.alpha.,3.beta.,6.beta.)]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
146.094294308 u |
Formula |
C7H14O3 |
InChI |
InChI=1S/C7H14O3/c1-5-6(8)3-4-7(9-2)10-5/h5-8H,3-4H2,1-2H3 |
InChIKey |
CWBJMXOKTZGNEH-UHFFFAOYSA-N |
Molecular Weight |
146.186 g/mol |
SMILES |
COC1OC(C)C(CC1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885069 |