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(3R,Rs)-N-(tert-Butoxycarbonyl)-3-amino-1-(p-tolylsulfinyl)-2-butanone
SpectraBase Compound ID 8eVjVelapCF
InChI InChI=1S/C16H23NO4S/c1-11-6-8-13(9-7-11)22(20)10-14(18)12(2)17-15(19)21-16(3,4)5/h6-9,12H,10H2,1-5H3,(H,17,19)/t12-,22?/m1/s1
InChIKey BYMIPJOKRVHCQX-PMOHQLOOSA-N
Mol Weight 325.42 g/mol
Molecular Formula C16H23NO4S
Exact Mass 325.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpqYoqSiM5u
Name (3R,Rs)-N-(tert-Butoxycarbonyl)-3-amino-1-(p-tolylsulfinyl)-2-butanone
Alternate Name(s) tert-Butyl (1R)-1-methyl-3-[(4-methylphenyl)sulfinyl]-2-oxopropylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO4S
InChI InChI=1S/C16H23NO4S/c1-11-6-8-13(9-7-11)22(20)10-14(18)12(2)17-15(19)21-16(3,4)5/h6-9,12H,10H2,1-5H3,(H,17,19)/t12-,22?/m1/s1
InChIKey BYMIPJOKRVHCQX-PMOHQLOOSA-N
Molecular Weight 325.423 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](C(C[S@](c1ccc(cc1)C)=O)=O)(C)[H]
SPLASH splash10-0006-9700000000-0eb2034cdb8031d828a1
Source of Spectrum QC-11-3085-3
Wiley ID 860006