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(4-Hydroxymethylphenyl)bis(5-ethoxycarbonyl-4-ethyl-3-methyl-2-pyrryl)methane
SpectraBase Compound ID 3G7qz5zycl5
InChI InChI=1S/C28H36N2O5/c1-7-20-16(5)23(29-25(20)27(32)34-9-3)22(19-13-11-18(15-31)12-14-19)24-17(6)21(8-2)26(30-24)28(33)35-10-4/h11-14,22,29-31H,7-10,15H2,1-6H3
InChIKey JJSACTAJBCKXDC-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C28H36N2O5
Exact Mass 480.262422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sXoQTqH92R
Name (4-Hydroxymethylphenyl)bis(5-ethoxycarbonyl-4-ethyl-3-methyl-2-pyrryl)methane
Alternate Name(s) 5-[(5-ethoxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)-[4-(hydroxymethyl)phenyl]methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 5-[(5-ethoxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)-[4-(hydroxymethyl)phenyl]methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylate
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Formula C28H36N2O5
InChI InChI=1S/C28H36N2O5/c1-7-20-16(5)23(29-25(20)27(32)34-9-3)22(19-13-11-18(15-31)12-14-19)24-17(6)21(8-2)26(30-24)28(33)35-10-4/h11-14,22,29-31H,7-10,15H2,1-6H3
InChIKey JJSACTAJBCKXDC-UHFFFAOYSA-N
Molecular Weight 480.605 g/mol
SMILES [nH]1c(c(c(c1C(c1ccc(CO)cc1)c1[nH]c(c(c1C)CC)C(=O)OCC)C)CC)C(=O)OCC
SPLASH splash10-0ue9-2036900000-065e8fb3e6ff95d7a0bd
Source of Spectrum QE-5-593-1
Wiley ID 844067