SpectraBase Compound ID | AtT26FziL0z |
---|---|
InChI | InChI=1S/C8H10O3/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,9-11H,3-4H2 |
InChIKey | JUUBCHWRXWPFFH-UHFFFAOYSA-N |
Mol Weight | 154.16 g/mol |
Molecular Formula | C8H10O3 |
Exact Mass | 154.062994 g/mol |
SpectraBase Spectrum ID | GW0JoS6Byu5 |
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Name | 3,4-Dihydroxy-beta-phenyl-ethanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 154.062994179 u |
Formula | C8H10O3 |
InChI | InChI=1S/C8H10O3/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,9-11H,3-4H2 |
InChIKey | JUUBCHWRXWPFFH-UHFFFAOYSA-N |
SMILES | C=1(O)C=C(CCO)C=CC1O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944592 |