SpectraBase Compound ID | UetTAuD8yC |
---|---|
InChI | InChI=1S/C12H19NO/c1-9(10(2)13-3)11-5-7-12(14-4)8-6-11/h5-10,13H,1-4H3 |
InChIKey | QJNIKEVKIPDGSH-UHFFFAOYSA-N |
Mol Weight | 193.29 g/mol |
Molecular Formula | C12H19NO |
Exact Mass | 193.146664 g/mol |
SpectraBase Spectrum ID | KRYqUrrzy3U |
---|---|
Name | 3-(4-Methoxyphenyl)-N-methylbutan-2-amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 193.146664235 u |
Formula | C12H19NO |
InChI | InChI=1S/C12H19NO/c1-9(10(2)13-3)11-5-7-12(14-4)8-6-11/h5-10,13H,1-4H3 |
InChIKey | QJNIKEVKIPDGSH-UHFFFAOYSA-N |
Molecular Weight | 193.290 g/mol |
SMILES | C1=CC(=CC=C1C(C(NC)C)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.820875 |