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(Ss,4R)-1-Benzyl-4-methyl-6-propyl-5-(p-tolylsulfinyl)-5,6-dehydropiperidin-2-one
SpectraBase Compound ID BSCEfhlBIlm
InChI InChI=1S/C23H27NO2S/c1-4-8-21-23(27(26)20-13-11-17(2)12-14-20)18(3)15-22(25)24(21)16-19-9-6-5-7-10-19/h5-7,9-14,18H,4,8,15-16H2,1-3H3/t18-,27?/m1/s1
InChIKey UQINITJIMWTHGP-XZATXCMXSA-N
Mol Weight 381.53 g/mol
Molecular Formula C23H27NO2S
Exact Mass 381.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvwL3KpQIJv
Name (Ss,4R)-1-Benzyl-4-methyl-6-propyl-5-(p-tolylsulfinyl)-5,6-dehydropiperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO2S
InChI InChI=1S/C23H27NO2S/c1-4-8-21-23(27(26)20-13-11-17(2)12-14-20)18(3)15-22(25)24(21)16-19-9-6-5-7-10-19/h5-7,9-14,18H,4,8,15-16H2,1-3H3/t18-,27?/m1/s1
InChIKey UQINITJIMWTHGP-XZATXCMXSA-N
Molecular Weight 381.534 g/mol
SMILES C1(=C(N(Cc2ccccc2)C(C[C@]1(C)[H])=O)CCC)[S@](c1ccc(cc1)C)=O
SPLASH splash10-0006-9007000000-35265f881c5b05ebfa8f
Source of Spectrum QC-12-3181-11
Wiley ID 1634785