| SpectraBase Spectrum ID |
HL5PAQAbHY |
| Name |
2,4-Furandiol, 3-chlorotetrahydro-3-methyl-, (2.alpha.,3.beta.,4.beta.)-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
152.024021847 u |
| Formula |
C5H9ClO3 |
| InChI |
InChI=1S/C5H9ClO3/c1-5(6)3(7)2-9-4(5)8/h3-4,7-8H,2H2,1H3/t3-,4-,5+/m0/s1 |
| InChIKey |
MFTKWBNVDSRDQF-VAYJURFESA-N |
| SMILES |
[C@]1([C@](OC[C@@]1(O)[H])(O)[H])(Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957134 |
