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1-((2'R)-3'-Acetylthio-2'-methylpropanoyl)-L-proline Phenyl Ester
SpectraBase Compound ID 7uEUCNdWWlt
InChI InChI=1S/C17H21NO4S/c1-12(11-23-13(2)19)16(20)18-10-6-9-15(18)17(21)22-14-7-4-3-5-8-14/h3-5,7-8,12,15H,6,9-11H2,1-2H3/t12-,15-/m0/s1
InChIKey SRVWRGMNTMXRIG-WFASDCNBSA-N
Mol Weight 335.42 g/mol
Molecular Formula C17H21NO4S
Exact Mass 335.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBtSHgFpk9m
Name 1-((2'R)-3'-Acetylthio-2'-methylpropanoyl)-L-proline Phenyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4S
InChI InChI=1S/C17H21NO4S/c1-12(11-23-13(2)19)16(20)18-10-6-9-15(18)17(21)22-14-7-4-3-5-8-14/h3-5,7-8,12,15H,6,9-11H2,1-2H3/t12-,15-/m0/s1
InChIKey SRVWRGMNTMXRIG-WFASDCNBSA-N
Molecular Weight 335.418 g/mol
SMILES C(N1[C@](C(Oc2ccccc2)=O)(CCC1)[H])([C@](CSC(=O)C)(C)[H])=O
SPLASH splash10-006x-5290000000-46ec36b476d3cf12893f
Source of Spectrum KD-16-1219-3
Synonyms phenyl (2S)-1-[(2R)-3-(acetylsulfanyl)-2-methylpropanoyl]-2-pyrrolidinecarboxylate
Wiley ID 1637582