SpectraBase Spectrum ID |
AxDePVvNrZB |
Name |
(E)-3-(2-Aminophenyl)-1-methylbut-3-en-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
177.115364106 u |
Formula |
C11H15NO |
InChI |
InChI=1S/C11H15NO/c1-11(2,13)8-7-9-5-3-4-6-10(9)12/h3-8,13H,12H2,1-2H3/b8-7+ |
InChIKey |
QOUKDBWDPFWWTA-BQYQJAHWSA-N |
Molecular Weight |
177.247 g/mol |
SMILES |
CC(C)(\C=C\C=1C(=CC=CC1)N)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893251 |