SpectraBase Spectrum ID |
7614PUFvZfO |
Name |
(3S)-1-ethyl-3-(4-oxotetrahydro-2H-thiopyran-3-yl)pyrrolidine-2,5-dione |
Appearance |
Pale yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H15NO3S |
InChI |
InChI=1S/C11H15NO3S/c1-2-12-10(14)5-7(11(12)15)8-6-16-4-3-9(8)13/h7-8H,2-6H2,1H3/t7-,8?/m0/s1 |
InChIKey |
XXPKTYYFFLHQIE-JAMMHHFISA-N |
Instrument Name |
Agilent 6890N-5973 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/adsc.202000335 |
Molecular Weight |
241.305 g/mol |
Reported Formula |
C11H15NO3S |
SMILES |
C1(=O)[C@](C2CSCCC2=O)(CC(=O)N1CC)[H] |
SPLASH |
splash10-014i-6900000000-af36b40c98d8de208bb3 |
Sample Comments |
diastereomer mixture of syn/anti (60:40) |
Source of Spectrum |
ASC-362-SM74-18df |
Wiley ID |
1855520 |