SpectraBase Compound ID | 24a9ehzsRxE |
---|---|
InChI | InChI=1S/C5H10O3/c6-1-5(2-7)3-8-4-5/h6-7H,1-4H2 |
InChIKey | QSGREIXRTDCBHO-UHFFFAOYSA-N |
Mol Weight | 118.13 g/mol |
Molecular Formula | C5H10O3 |
Exact Mass | 118.062994 g/mol |
SpectraBase Spectrum ID | EJS3NeLxSkY |
---|---|
Name | [3-(Hydroxymethyl)oxetan-3-yl]methanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 118.062994179 u |
Formula | C5H10O3 |
InChI | InChI=1S/C5H10O3/c6-1-5(2-7)3-8-4-5/h6-7H,1-4H2 |
InChIKey | QSGREIXRTDCBHO-UHFFFAOYSA-N |
Molecular Weight | 118.132 g/mol |
SMILES | C1OCC1(CO)CO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948338 |