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BOC-(S)-Pro-(S)-Hiva-(S)-DPy

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BOC-(S)-Pro-(S)-Hiva-(S)-DPy
SpectraBase Compound ID 6tFq7x3xqqu
InChI InChI=1S/C27H36N2O7/c1-17(2)23(35-25(32)19-13-10-14-28(19)26(33)36-27(3,4)5)24(31)29-20(21(34-6)16-22(29)30)15-18-11-8-7-9-12-18/h7-9,11-12,16-17,19-20,23H,10,13-15H2,1-6H3/t19-,20-,23-/m0/s1
InChIKey KQTMXYXETATGOB-JTAQYXEDSA-N
Mol Weight 500.6 g/mol
Molecular Formula C27H36N2O7
Exact Mass 500.252252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UcuZ4uSjoD
Name BOC-(S)-Pro-(S)-Hiva-(S)-DPy
Alternate Name(s) (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(2S)-1-[(2S)-3-methoxy-5-oxo-2-(phenylmethyl)-2H-pyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]ester (2S)-pyrrolidine-1,2-dicarboxylic acid O2-[(1S)-1-[(2S)-2-benzyl-5-keto-3-methoxy-3-pyrroline-1-carbonyl]-2-methyl-propyl]ester O1-tert-butyl ester 2-((1S)-1-{[(2S)-2-benzyl-3-methoxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]carbonyl}-2-methylpropyl) 1-tert-butyl (2S)-1,2-pyrrolidinedicarboxylate 2-O-[(2S)-1-[(2S)-2-benzyl-3-methoxy-5-oxo-2H-pyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]1-O-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate O1-tert-butyl O2-[(2S)-1-[(2S)-3-methoxy-5-oxidanylidene-2-(phenylmethyl)-2H-pyrrol-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl](2S)-pyrrolidine-1,2-dicarboxylate O2-[(1S)-1-[(2S)-2-benzyl-3-methoxy-5-oxo-2H-pyrrole-1-carbonyl]-2-methyl-propyl]O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(2S)-1-[(2S)-3-methoxy-5-oxo-2-(phenylmethyl)-2H-pyrrol-1-yl]-3-methyl-1-oxobutan-2-yl] ester 2-O-[(2S)-1-[(2S)-2-benzyl-3-methoxy-5-oxo-2H-pyrrol-1-yl]-3-methyl-1-oxobutan-2-yl] 1-O-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate O2-[(1S)-1-[(2S)-2-benzyl-3-methoxy-5-oxo-2H-pyrrole-1-carbonyl]-2-methyl-propyl] O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate O1-tert-butyl O2-[(2S)-1-[(2S)-3-methoxy-5-oxidanylidene-2-(phenylmethyl)-2H-pyrrol-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-pyrrolidine-1,2-dicarboxylate
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Formula C27H36N2O7
InChI InChI=1S/C27H36N2O7/c1-17(2)23(35-25(32)19-13-10-14-28(19)26(33)36-27(3,4)5)24(31)29-20(21(34-6)16-22(29)30)15-18-11-8-7-9-12-18/h7-9,11-12,16-17,19-20,23H,10,13-15H2,1-6H3/t19-,20-,23-/m0/s1
InChIKey KQTMXYXETATGOB-JTAQYXEDSA-N
Molecular Weight 500.592 g/mol
SMILES C(N1C(C=C([C@@]1(Cc1ccccc1)[H])OC)=O)([C@@](OC([C@]1(N(C(OC(C)(C)C)=O)CCC1)[H])=O)(C(C)C)[H])=O
SPLASH splash10-03di-0920000000-638f40f48012ee1b113a
Source of Spectrum F-50-12103-5
Wiley ID 789881