SpectraBase Compound ID | 1S7Jz6aM2HA |
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InChI | InChI=1S/C12H19NO2/c1-10(11-5-3-2-4-6-11)12(15)9-13-7-8-14/h2-6,10,12-15H,7-9H2,1H3 |
InChIKey | DQYVKCUIQRJSIA-UHFFFAOYSA-N |
Mol Weight | 209.29 g/mol |
Molecular Formula | C12H19NO2 |
Exact Mass | 209.141579 g/mol |
SpectraBase Spectrum ID | E7M25t4sP9U |
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Name | alpha-{[(2-hydroxyethyl)amino]methyl}-beta-methylphenethyl alcohol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 209.141578854 u |
Formula | C12H19NO2 |
InChI | InChI=1S/C12H19NO2/c1-10(11-5-3-2-4-6-11)12(15)9-13-7-8-14/h2-6,10,12-15H,7-9H2,1H3 |
InChIKey | DQYVKCUIQRJSIA-UHFFFAOYSA-N |
SMILES | N(CC(C(C1=CC=CC=C1)C)O)CCO |
Spectrum/Structure Validation Score (Raman) | 0.994823 |