| SpectraBase Spectrum ID |
HfOGUs6H1FI |
| Name |
3-Benzyloxy-2-[(2'-(methoxymethyl)pyrrolidin-1'-yl)amino]propyl phenyl sulfone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.192628624 u |
| Formula |
C22H30N2O4S |
| InChI |
InChI=1S/C22H30N2O4S/c1-27-17-21-11-8-14-24(21)23-20(16-28-15-19-9-4-2-5-10-19)18-29(25,26)22-12-6-3-7-13-22/h2-7,9-10,12-13,20-21,23H,8,11,14-18H2,1H3 |
| InChIKey |
RTCMJPJOEVEKPG-UHFFFAOYSA-N |
| Molecular Weight |
418.552 g/mol |
| SMILES |
C(S(=O)(=O)C=1C=CC=CC1)C(NN1C(COC)CCC1)COCC=1C=CC=CC1 |