| SpectraBase Spectrum ID |
3DCvxDNYHWO |
| Name |
(2RS,3RS,3'SR)-3-Hydroxy-2-methyl-3-(3'-phenylthio-1'-azabicyclo[2.2.2]octan-3'-yl)propyl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H29NO3S |
| InChI |
InChI=1S/C24H29NO3S/c1-18(16-28-23(27)19-8-4-2-5-9-19)22(26)24(29-21-10-6-3-7-11-21)17-25-14-12-20(24)13-15-25/h2-11,18,20,22,26H,12-17H2,1H3/t18-,22-,24+/m0/s1 |
| InChIKey |
LONKYSAMFAIWCA-JKFKMHIGSA-N |
| Molecular Weight |
411.560 g/mol |
| SMILES |
O[C@]([C@@]1(Sc2ccccc2)CN2CCC1CC2)([C@](COC(=O)c1ccccc1)(C)[H])[H] |
| SPLASH |
splash10-0c00-0910000000-a43e652e61998465954a |
| Source of Spectrum |
KC-1992-2306-30 |
| Synonyms |
(2S,3S)-3-Hydroxy-2-methyl-3-(3'-phenylthio-1'-azabicyclo[2.2.2]octan-3'-yl)propyl benzoate
(2S,3S)-3-hydroxy-2-methyl-3-[3-(phenylsulfanyl)-1-azabicyclo[2.2.2]oct-3-yl]propyl benzoate |
| Wiley ID |
776804 |
![(2RS,3RS,3'SR)-3-Hydroxy-2-methyl-3-(3'-phenylthio-1'-azabicyclo[2.2.2]octan-3'-yl)propyl benzoate](/api/spectrum/3DCvxDNYHWO/structure.png?h=300&w=458 "(2RS,3RS,3'SR)-3-Hydroxy-2-methyl-3-(3'-phenylthio-1'-azabicyclo[2.2.2]octan-3'-yl)propyl benzoate")
