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(3R,5S)-3-amino-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-5-(methylthio)-2-piperidone

View entire compound with spectra: 1 MS (GC)

(3R,5S)-3-amino-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-5-(methylthio)-2-piperidone
SpectraBase Compound ID 7CtgLK9OwFP
InChI InChI=1S/C14H20N2O2S/c1-19-11-7-12(15)14(18)16(8-11)13(9-17)10-5-3-2-4-6-10/h2-6,11-13,17H,7-9,15H2,1H3/t11-,12+,13-/m0/s1
InChIKey ARNFRVGFSGRJLM-XQQFMLRXSA-N
Mol Weight 280.39 g/mol
Molecular Formula C14H20N2O2S
Exact Mass 280.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BhPbkwfYvQ
Name (3R,5S)-3-amino-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-5-(methylthio)-2-piperidone
Alternate Name(s) (3R,5S)-3-amino-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-5-methylsulfanyl-piperidin-2-one (3R,5S)-3-amino-1-[(1R)-2-hydroxy-1-phenylethyl]-5-(methylthio)-2-piperidinone (3R,5S)-3-azanyl-5-methylsulfanyl-1-[(1R)-2-oxidanyl-1-phenyl-ethyl]piperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2O2S
InChI InChI=1S/C14H20N2O2S/c1-19-11-7-12(15)14(18)16(8-11)13(9-17)10-5-3-2-4-6-10/h2-6,11-13,17H,7-9,15H2,1H3/t11-,12+,13-/m0/s1
InChIKey ARNFRVGFSGRJLM-XQQFMLRXSA-N
Molecular Weight 280.386 g/mol
SMILES N[C@]1(C(N([C@@](CO)(c2ccccc2)[H])C[C@](C1)(SC)[H])=O)[H]
SPLASH splash10-0a4i-0930000000-bc66e841fa2e65a04379
Source of Spectrum F-52-7734-1
Wiley ID 796754