| SpectraBase Spectrum ID |
C3T9hm96c78 |
| Name |
(S)-2-(2-hydroxy-3-methylbutylthio)naphthalene-1,4-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H16O3S |
| InChI |
InChI=1S/C15H16O3S/c1-9(2)13(17)8-19-14-7-12(16)10-5-3-4-6-11(10)15(14)18/h3-7,9,13,17H,8H2,1-2H3/t13-/m1/s1 |
| InChIKey |
DRCUVYUKAQVYCU-CYBMUJFWSA-N |
| Ionization Type |
EI |
| Molecular Weight |
276.350 g/mol |
| Optical Rotation |
[a]D20 = -17.8 (c = 0.50, EtOAc) |
| Reported Formula |
C15H16O3S |
| SMILES |
O[C@](CSC=1C(c2ccccc2C(C1)=O)=O)(C(C)C)[H] |
| SPLASH |
splash10-0ufr-1890000000-752eacf88b16c660d7a6 |
| Source of Spectrum |
TW201534295A |
| Wiley ID |
1852814 |
