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Methyl 3-(4-morpholinyl)-1-palmitoyl-4-phenyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID BMCSRdFuwYq
InChI InChI=1S/C32H48N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-29(35)34-26-28(27-19-16-15-17-20-27)30(31(34)32(36)37-2)33-22-24-38-25-23-33/h15-17,19-20,26H,3-14,18,21-25H2,1-2H3
InChIKey KDNJTQQLHPTELZ-UHFFFAOYSA-N
Mol Weight 524.7 g/mol
Molecular Formula C32H48N2O4
Exact Mass 524.361408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3IbPzI3SMK
Name Methyl 3-(4-morpholinyl)-1-palmitoyl-4-phenyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H48N2O4
InChI InChI=1S/C32H48N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-21-29(35)34-26-28(27-19-16-15-17-20-27)30(31(34)32(36)37-2)33-22-24-38-25-23-33/h15-17,19-20,26H,3-14,18,21-25H2,1-2H3
InChIKey KDNJTQQLHPTELZ-UHFFFAOYSA-N
Molecular Weight 524.746 g/mol
SMILES c1[n](c(C(OC)=O)c(c1-c1ccccc1)N1CCOCC1)C(CCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-9470000000-2a90d83b68b252907e57
Source of Spectrum NP-15-8543-0
Synonyms N-Palmitoyl-3-morpholino-4-phenylpyrrol-2-carboxylic acid, methyl ester 3-(4-morpholinyl)-1-(1-oxohexadecyl)-4-phenyl-2-pyrrolecarboxylic acid methyl ester Methyl 1-hexadecanoyl-3-morpholin-4-yl-4-phenylpyrrole-2-carboxylate Methyl 1-hexadecanoyl-3-morpholino-4-phenyl-pyrrole-2-carboxylate Methyl 1-hexadecanoyl-3-morpholin-4-yl-4-phenyl-pyrrole-2-carboxylate
Wiley ID 1112931