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(Z,2RS,3SR)-4,5-DIHYDRO-2,3-DIHYDRO-3-(2-HYDROXYETHYL)-8-[2-(METHOXYCARBONYL)-ETHYL]-2,7-DIMETHYL-DIPYRRIN-1(10H)-ONE
SpectraBase Compound ID HOQ6x05tPOR
InChI InChI=1S/C18H24N2O5/c1-10-12(4-5-17(23)25-3)16(9-22)19-14(10)8-15-13(6-7-21)11(2)18(24)20-15/h8-9,11,13,19,21H,4-7H2,1-3H3,(H,20,24)/b15-8-/t11-,13+/m0/s1
InChIKey ZLKNKRKXUJKIBM-AMUVPKJUSA-N
Mol Weight 348.4 g/mol
Molecular Formula C18H24N2O5
Exact Mass 348.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hn58W2QuVd
Name 1H-Pyrrole-3-propanoic acid, 2-formyl-5-[[3-(2-hydroxyethyl)-4-methyl-5-oxo-2-pyrrolidinylidene]methyl]-4-methyl-, methyl ester, (2Z,3.alpha.,4.alpha.)-(.+-.)-
CAS Registry Number 125090-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O5
InChI InChI=1S/C18H24N2O5/c1-10-12(4-5-17(23)25-3)16(9-22)19-14(10)8-15-13(6-7-21)11(2)18(24)20-15/h8-9,11,13,19,21H,4-7H2,1-3H3,(H,20,24)/b15-8-/t11-,13+/m0/s1
InChIKey ZLKNKRKXUJKIBM-AMUVPKJUSA-N
Molecular Weight 348.399 g/mol
SMILES N1C([C@]([C@@](CCO)(\C1=C/c1[nH]c(c(c1C)CCC(=O)OC)C=O)[H])(C)[H])=O
SPLASH splash10-004j-3902000000-b0c802fbc51b60c99a59
Source of Spectrum H-72-525-11
Synonyms (Z,2RS,3SR)-9-formyl-2,3-dihydro-3-(2-hydroxyethyl)-8-[2-(methoxycarbonyl}ethyl]-2,7-dimethyldipyrrin-1(10H)-one Methyl 3-(2-formyl-5-{(Z)-[(3R,4S)-3-(2-hydroxyethyl)-4-methyl-5-oxopyrrolidinylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoate
Wiley ID 1340532