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(2S,3S,RS) and (2R,3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-4-phenyl-1-(p-tolylsulfinyl)-2-butanonl
SpectraBase Compound ID 71v0a3xZQ7A
InChI InChI=1S/C22H29NO4S/c1-16-10-12-18(13-11-16)28(26)15-20(24)19(14-17-8-6-5-7-9-17)23-21(25)27-22(2,3)4/h5-13,19-20,24H,14-15H2,1-4H3,(H,23,25)/t19-,20?,28?/m0/s1
InChIKey PXLTYPYPPJHTEV-MPBYYLQUSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H3UJZ71bo5s
Name (2S,3S,RS) and (2R,3S,RS)-N-(tert-Butoxycarbonyl)-3-amino-4-phenyl-1-(p-tolylsulfinyl)-2-butanonl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO4S
InChI InChI=1S/C22H29NO4S/c1-16-10-12-18(13-11-16)28(26)15-20(24)19(14-17-8-6-5-7-9-17)23-21(25)27-22(2,3)4/h5-13,19-20,24H,14-15H2,1-4H3,(H,23,25)/t19-,20?,28?/m0/s1
InChIKey PXLTYPYPPJHTEV-MPBYYLQUSA-N
Molecular Weight 403.537 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(C[S@@](c1ccc(C)cc1)=O)O)(Cc1ccccc1)[H]
SPLASH splash10-0ab9-4930000000-0d14b9f347136d58f3d1
Source of Spectrum F-65-360-3b
Wiley ID 1682117