| SpectraBase Spectrum ID |
IG68i3tKRoK |
| Name |
2-(1',3'-Dihydroisoindol-2'-yl)-4-(methylthio)butanoic acid |
| Alternate Name(s) |
(2S)-2-(1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoic acid
(S)-2-(1,3-Dihydroisoindol-2-yl)-4-methylsulfanylbutanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NO2S |
| InChI |
InChI=1S/C13H17NO2S/c1-17-7-6-12(13(15)16)14-8-10-4-2-3-5-11(10)9-14/h2-5,12H,6-9H2,1H3,(H,15,16)/t12-/m0/s1 |
| InChIKey |
OMSDADZXSVCIFE-LBPRGKRZSA-N |
| Molecular Weight |
251.344 g/mol |
| SMILES |
OC([C@@](N1Cc2ccccc2C1)(CCSC)[H])=O |
| SPLASH |
splash10-014i-0920000000-22081595fdc882f59629 |
| Source of Spectrum |
OP-33-347-4 |
| Wiley ID |
1577894 |
