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(3R,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-4-(o-nitrobenzenesulfonamido)-3-morpholinopiperidin-2-one

View entire compound with spectra: 1 MS (GC)

(3R,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-4-(o-nitrobenzenesulfonamido)-3-morpholinopiperidin-2-one
SpectraBase Compound ID LFn0uExgDHZ
InChI InChI=1S/C32H44N4O9S/c1-22(2)19-25(31(38)45-32(3,4)5)35-20-26(44-21-23-11-7-6-8-12-23)28(29(30(35)37)34-15-17-43-18-16-34)33-46(41,42)27-14-10-9-13-24(27)36(39)40/h6-14,22,25-26,28-29,33H,15-21H2,1-5H3/t25-,26+,28-,29+/m0/s1
InChIKey FGHITCKDSROZJG-IXGYBEARSA-N
Mol Weight 660.8 g/mol
Molecular Formula C32H44N4O9S
Exact Mass 660.2829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RbDnCKAAaw
Name (3R,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-4-(o-nitrobenzenesulfonamido)-3-morpholinopiperidin-2-one
Alternate Name(s) tert-Butyl (2S)-2-((3R,4R,5R)-5-(benzyloxy)-3-(4-morpholinyl)-4-{[(2-nitrophenyl)sulfonyl]amino}-2-oxopiperidinyl)-4-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H44N4O9S
InChI InChI=1S/C32H44N4O9S/c1-22(2)19-25(31(38)45-32(3,4)5)35-20-26(44-21-23-11-7-6-8-12-23)28(29(30(35)37)34-15-17-43-18-16-34)33-46(41,42)27-14-10-9-13-24(27)36(39)40/h6-14,22,25-26,28-29,33H,15-21H2,1-5H3/t25-,26+,28-,29+/m0/s1
InChIKey FGHITCKDSROZJG-IXGYBEARSA-N
Molecular Weight 660.783 g/mol
SMILES N([C@@]1([C@](C(=O)N(C[C@]1(OCc1ccccc1)[H])[C@](C(OC(C)(C)C)=O)(CC(C)C)[H])(N1CCOCC1)[H])[H])S(c1c(N(=O)=O)cccc1)(=O)=O
SPLASH splash10-0006-9100000000-4f589838815c35104747
Source of Spectrum KD-13-1002-12
Wiley ID 1635212