| SpectraBase Compound ID | 87g19v54NAM |
|---|---|
| InChI | InChI=1S/C7H12O6/c8-2-7-6(11)4(10)5(13-7)3(9)1-12-7/h3-6,8-11H,1-2H2 |
| InChIKey | XADHWRROXGBDQQ-UHFFFAOYSA-N |
| Mol Weight | 192.17 g/mol |
| Molecular Formula | C7H12O6 |
| Exact Mass | 192.063388 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | El8NVyxvs3n |
|---|---|
| Name | 2,7-Anhydro-L-galacto-heptulofuranose |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.063388100 u |
| Formula | C7H12O6 |
| InChI | InChI=1S/C7H12O6/c8-2-7-6(11)4(10)5(13-7)3(9)1-12-7/h3-6,8-11H,1-2H2 |
| InChIKey | XADHWRROXGBDQQ-UHFFFAOYSA-N |
| Molecular Weight | 192.167 g/mol |
| SMILES | C12OC(OCC2O)(CO)C(C1O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.917733 |