SpectraBase Compound ID | FHinN5DUiuu |
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InChI | InChI=1S/C8H8O2/c9-6-8(10)7-4-2-1-3-5-7/h1-6,8,10H |
InChIKey | JCISRQNKHZNVHJ-UHFFFAOYSA-N |
Mol Weight | 136.15 g/mol |
Molecular Formula | C8H8O2 |
Exact Mass | 136.052429 g/mol |
SpectraBase Spectrum ID | Kdu4vOOG2aZ |
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Name | .Alpa.-hydroxybenzylcarboraldehyde |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 136.052429496 u |
Formula | C8H8O2 |
InChI | InChI=1S/C8H8O2/c9-6-8(10)7-4-2-1-3-5-7/h1-6,8,10H |
InChIKey | JCISRQNKHZNVHJ-UHFFFAOYSA-N |
Molecular Weight | 136.150 g/mol |
SMILES | C(=O)C(C1=CC=CC=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.831202 |