| SpectraBase Compound ID | LU2p4ArRnTa |
|---|---|
| InChI | InChI=1S/C8H16O6/c1-11-4-5(12-2)7(9)14-8(10)6(4)13-3/h4-10H,1-3H3 |
| InChIKey | GBWRQSGNCJKOKF-UHFFFAOYSA-N |
| Mol Weight | 208.21 g/mol |
| Molecular Formula | C8H16O6 |
| Exact Mass | 208.094688 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BpnSr5Ejq4b |
|---|---|
| Name | D-Xylopyranose, 5-C-hydroxy-2,3,4-tri-o-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.094688229 u |
| Formula | C8H16O6 |
| InChI | InChI=1S/C8H16O6/c1-11-4-5(12-2)7(9)14-8(10)6(4)13-3/h4-10H,1-3H3 |
| InChIKey | GBWRQSGNCJKOKF-UHFFFAOYSA-N |
| Molecular Weight | 208.210 g/mol |
| SMILES | COC1C(OC)C(O)OC(C1OC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.812035 |