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(3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-5-methyl-1-(p-tolylsulfinyl)-2-hexanone
SpectraBase Compound ID 1ymXnZQjvWS
InChI InChI=1S/C19H29NO4S/c1-13(2)11-16(20-18(22)24-19(4,5)6)17(21)12-25(23)15-9-7-14(3)8-10-15/h7-10,13,16H,11-12H2,1-6H3,(H,20,22)/t16-,25?/m0/s1
InChIKey ZTDHZNSFQWXAEO-YPHZTSLFSA-N
Mol Weight 367.5 g/mol
Molecular Formula C19H29NO4S
Exact Mass 367.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjoHchAQ8K6
Name (3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-5-methyl-1-(p-tolylsulfinyl)-2-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29NO4S
InChI InChI=1S/C19H29NO4S/c1-13(2)11-16(20-18(22)24-19(4,5)6)17(21)12-25(23)15-9-7-14(3)8-10-15/h7-10,13,16H,11-12H2,1-6H3,(H,20,22)/t16-,25?/m0/s1
InChIKey ZTDHZNSFQWXAEO-YPHZTSLFSA-N
Molecular Weight 367.504 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(CS(c1ccc(cc1)C)=O)=O)(CC(C)C)[H]
SPLASH splash10-0019-7900000000-e300b7180d80a0836391
Source of Spectrum F-65-359-2c
Wiley ID 1682120