SpectraBase Compound ID | KO3OKpNXsr0 |
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InChI | InChI=1S/C8H11NO2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,10-11H,4-5,9H2 |
InChIKey | XYCAOJYRZJFHAZ-UHFFFAOYSA-N |
Mol Weight | 153.18 g/mol |
Molecular Formula | C8H11NO2 |
Exact Mass | 153.078979 g/mol |
SpectraBase Spectrum ID | 7T8fZfAUDyx |
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Name | (5-Amino-2-hydroxymethyl-phenyl)-methanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 153.078978596 u |
Formula | C8H11NO2 |
InChI | InChI=1S/C8H11NO2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,10-11H,4-5,9H2 |
InChIKey | XYCAOJYRZJFHAZ-UHFFFAOYSA-N |
Molecular Weight | 153.181 g/mol |
SMILES | C1(=C(C=CC(=C1)N)CO)CO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959209 |