SpectraBase Compound ID | 20ejuSdOPKS |
---|---|
InChI | InChI=1S/C20H23NO3/c1-14(22)16-10-11-17(23)18(20(16)24)19(15-8-4-2-5-9-15)21-12-6-3-7-13-21/h2,4-5,8-11,19,23-24H,3,6-7,12-13H2,1H3 |
InChIKey | DEFIHAASWLDTJC-UHFFFAOYSA-N |
Mol Weight | 325.41 g/mol |
Molecular Formula | C20H23NO3 |
Exact Mass | 325.167794 g/mol |
SpectraBase Spectrum ID | EjLJSn2kALJ |
---|---|
Name | 2',4'-Dihydroxy-3'-(alpha-piperidinobenzyl)acetophenone |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 325.167793602 u |
Formula | C20H23NO3 |
InChI | InChI=1S/C20H23NO3/c1-14(22)16-10-11-17(23)18(20(16)24)19(15-8-4-2-5-9-15)21-12-6-3-7-13-21/h2,4-5,8-11,19,23-24H,3,6-7,12-13H2,1H3 |
InChIKey | DEFIHAASWLDTJC-UHFFFAOYSA-N |
SMILES | OC1=C(C(=C(C=C1)C(C)=O)O)C(N1CCCCC1)C1=CC=CC=C1 |