| SpectraBase Spectrum ID |
IabUEdDM44K |
| Name |
S-Ethyl (2R,3S)-3-Methyl-2-(4-nitrophenyl)-5-oxopentanethioate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17NO4S |
| InChI |
InChI=1S/C14H17NO4S/c1-3-20-14(17)13(10(2)8-9-16)11-4-6-12(7-5-11)15(18)19/h4-7,9-10,13H,3,8H2,1-2H3/t10-,13?/m0/s1 |
| InChIKey |
GZRVSFRPTVHZJI-NKUHCKNESA-N |
| Molecular Weight |
295.353 g/mol |
| SMILES |
c1(N(=O)=O)ccc(C(C(=O)SCC)[C@](CC=O)(C)[H])cc1 |
| SPLASH |
splash10-0aor-2980000000-9a4ac96e9a9766dfeef0 |
| Source of Spectrum |
U1-2013-7071-3b |
| Synonyms |
S-Ethyl (3S)-3-Methyl-2-(4-nitrophenyl)-5-oxopentanethioate
(3S)-S-ethyl 3-methyl-2-(4-nitrophenyl)-5-oxopentanethioate |
| Wiley ID |
1736203 |
