| SpectraBase Spectrum ID |
JNkL3vvHEZn |
| Name |
(1S,2S)-2-Dimethylamino-1-(4-methylthiophenyl)-1,3-propanediol methiodide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22INO2S |
| InChI |
InChI=1S/C12H19NO2S.CH3I/c1-13(2)11(8-14)12(15)9-4-6-10(16-3)7-5-9;1-2/h4-7,11-12,14-15H,8H2,1-3H3;1H3/t11-,12-;/m0./s1 |
| InChIKey |
JAAJDCYSDMBLHT-FXMYHANSSA-N |
| Molecular Weight |
383.288 g/mol |
| SMILES |
CI.OC[C@@]([C@@](O)(c1ccc(cc1)SC)[H])(N(C)C)[H] |
| SPLASH |
splash10-0f79-6900000000-a27d7bb567d8980bf53a |
| Source of Spectrum |
QC-17-1751-5 |
| Synonyms |
(1S,2S)-2-(dimethylamino)-1-[4-(methylsulfanyl)phenyl]-1,3-propanediol compound with iodomethane (1:1) |
| Wiley ID |
1638340 |
