SpectraBase Spectrum ID |
Kkg0shULwhd |
Name |
Dimethyl trans-1-[2-chloro-3-(phenylthio)propionyl]pyrrolidine-2,5-dicarboxylate |
CAS Registry Number |
118335-80-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20ClNO5S |
InChI |
InChI=1S/C17H20ClNO5S/c1-23-16(21)13-8-9-14(17(22)24-2)19(13)15(20)12(18)10-25-11-6-4-3-5-7-11/h3-7,12-14H,8-10H2,1-2H3/t12?,13-,14-/m0/s1 |
InChIKey |
JYIPUAYQBAYVPV-TTZKSVMKSA-N |
Molecular Weight |
385.862 g/mol |
SMILES |
C(N1[C@](C(=O)OC)(CC[C@]1(C(=O)OC)[H])[H])(C(CSc1ccccc1)Cl)=O |
SPLASH |
splash10-03fr-0911000000-17e3cf2d77e123480f16 |
Source of Spectrum |
K-122-549-8 |
Synonyms |
Dimethyl (2S,5S)-1-[2-chloro-3-(phenylsulfanyl)propanoyl]-2,5-pyrrolidinedicarboxylate |
Wiley ID |
1362103 |