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Methyl (S)-2-[(benzyloxy)carbonylamino]-3-{ 1'-[(t-butyloxy)carbonyl]-1H-pyrrol-2'-yl}propanoate
SpectraBase Compound ID KBB1IEQbT1c
InChI InChI=1S/C21H26N2O6/c1-21(2,3)29-20(26)23-12-8-11-16(23)13-17(18(24)27-4)22-19(25)28-14-15-9-6-5-7-10-15/h5-12,17H,13-14H2,1-4H3,(H,22,25)/t17-/m0/s1
InChIKey MJAWHTWOTJNNQU-KRWDZBQOSA-N
Mol Weight 402.45 g/mol
Molecular Formula C21H26N2O6
Exact Mass 402.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vQIiGKtfdj
Name Methyl (S)-2-[(benzyloxy)carbonylamino]-3-{ 1'-[(t-butyloxy)carbonyl]-1H-pyrrol-2'-yl}propanoate
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Formula C21H26N2O6
InChI InChI=1S/C21H26N2O6/c1-21(2,3)29-20(26)23-12-8-11-16(23)13-17(18(24)27-4)22-19(25)28-14-15-9-6-5-7-10-15/h5-12,17H,13-14H2,1-4H3,(H,22,25)/t17-/m0/s1
InChIKey MJAWHTWOTJNNQU-KRWDZBQOSA-N
Molecular Weight 402.447 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](Cc1[n](C(OC(C)(C)C)=O)ccc1)(C(=O)OC)[H]
SPLASH splash10-053u-9000000000-af9b0180b7b4cff27b01
Source of Spectrum H-77-1406-0
Synonyms tert-Butyl 2-((2S)-2-{[(benzyloxy)carbonyl]amino}-3-methoxy-3-oxopropyl)-1H-pyrrole-1-carboxylate
Wiley ID 1370313