| SpectraBase Spectrum ID |
4OM6PwWDcbA |
| Name |
(S,S)-3-(2-Methylphenylsulfinyl)butanoic acid isomer |
| Alternate Name(s) |
(3S)-3-[(2-methylphenyl)sulfinyl]butanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14O3S |
| InChI |
InChI=1S/C11H14O3S/c1-8-5-3-4-6-10(8)15(14)9(2)7-11(12)13/h3-6,9H,7H2,1-2H3,(H,12,13)/t9-,15?/m0/s1 |
| InChIKey |
UXKZWWFZAAVLDK-HJULIUOESA-N |
| Molecular Weight |
226.290 g/mol |
| SMILES |
OC(C[C@@]([S@@](c1c(C)cccc1)=O)(C)[H])=O |
| SPLASH |
splash10-000m-9000000000-64d253cd95746c7b6aef |
| Source of Spectrum |
SO-0-88-3 |
| Wiley ID |
1542852 |
