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(3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-4-methyl-1-(p-tolylsulfinyl)-2-pentanone
SpectraBase Compound ID DMr9oxnBv3
InChI InChI=1S/C18H27NO4S/c1-12(2)16(19-17(21)23-18(4,5)6)15(20)11-24(22)14-9-7-13(3)8-10-14/h7-10,12,16H,11H2,1-6H3,(H,19,21)/t16-,24?/m0/s1
InChIKey ILEFRUZUCTVVFT-FXIRQEPWSA-N
Mol Weight 353.48 g/mol
Molecular Formula C18H27NO4S
Exact Mass 353.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3a1BvxEakBD
Name (3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-4-methyl-1-(p-tolylsulfinyl)-2-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27NO4S
InChI InChI=1S/C18H27NO4S/c1-12(2)16(19-17(21)23-18(4,5)6)15(20)11-24(22)14-9-7-13(3)8-10-14/h7-10,12,16H,11H2,1-6H3,(H,19,21)/t16-,24?/m0/s1
InChIKey ILEFRUZUCTVVFT-FXIRQEPWSA-N
Molecular Weight 353.477 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(CS(c1ccc(cc1)C)=O)=O)(C(C)C)[H]
SPLASH splash10-00di-9800000000-827bef2c2e26768597dd
Source of Spectrum F-65-359-2d
Wiley ID 1682119