| SpectraBase Spectrum ID |
KRP087sH0e9 |
| Name |
1-Piperidineethanol, 2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]-.beta.-phenyl-, [1R-(R*,R*)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.261693988 u |
| Formula |
C22H35NO3 |
| InChI |
InChI=1S/C22H35NO3/c1-2-3-13-22(25-16-17-26-22)14-12-20-11-7-8-15-23(20)21(18-24)19-9-5-4-6-10-19/h4-6,9-10,20-21,24H,2-3,7-8,11-18H2,1H3/t20-,21+/m1/s1 |
| InChIKey |
CGSWHJVJZWCJNY-RTWAWAEBSA-N |
| Molecular Weight |
361.526 g/mol |
| SMILES |
[C@](N1[C@@](CCC2(OCCO2)CCCC)(CCCC1)[H])(C=1C=CC=CC1)(CO)[H] |
![1-Piperidineethanol, 2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]-.beta.-phenyl-, [1R-(R*,R*)]-](/api/spectrum/KRP087sH0e9/structure.png?h=300&w=458 "1-Piperidineethanol, 2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]-.beta.-phenyl-, [1R-(R*,R*)]-")
