| SpectraBase Spectrum ID |
IyoustxBwnE |
| Name |
N-{-[alpha-(isopropylcarbonyl)methyl]-4'-methoxybenzyl}-3-chloroaniline |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.133906650 u |
| Formula |
C19H22ClNO2 |
| InChI |
InChI=1S/C19H22ClNO2/c1-13(2)19(22)12-18(14-7-9-17(23-3)10-8-14)21-16-6-4-5-15(20)11-16/h4-11,13,18,21H,12H2,1-3H3 |
| InChIKey |
RGGZSZMWJHPSOH-UHFFFAOYSA-N |
| Molecular Weight |
331.843 g/mol |
| SMILES |
C(C(NC=1C=C(Cl)C=CC1)C1=CC=C(C=C1)OC)C(=O)C(C)C |
![N-{-[.alpha.-(Isopropylcarbonyl)methyl]-4'-methoxybenzyl}-3-chloroaniline](/api/spectrum/IyoustxBwnE/structure.png?h=300&w=458 "N-{-[.alpha.-(Isopropylcarbonyl)methyl]-4'-methoxybenzyl}-3-chloroaniline")
