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2,5-Bis[(5-formyl-3-[2-methoxycarbonylmethyl]-4-methyl-1H-pyrrole-2-yl)methyl]-3,4-dimethylpyrrole
SpectraBase Compound ID 9Ob3zgOnYPP
InChI InChI=1S/C26H31N3O6/c1-13-14(2)20(10-22-18(8-26(33)35-6)16(4)24(12-31)29-22)27-19(13)9-21-17(7-25(32)34-5)15(3)23(11-30)28-21/h11-12,27-29H,7-10H2,1-6H3
InChIKey NHLBXQZXEDQSNQ-UHFFFAOYSA-N
Mol Weight 481.55 g/mol
Molecular Formula C26H31N3O6
Exact Mass 481.221286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID umxlf8R4iz
Name 2,5-Bis[(5-formyl-3-[2-methoxycarbonylmethyl]-4-methyl-1H-pyrrole-2-yl)methyl]-3,4-dimethylpyrrole
Alternate Name(s) Methyl {5-formyl-2-[(5-{[5-formyl-3-(2-methoxy-2-oxoethyl)-4-methyl-1H-pyrrol-2-yl]methyl}-3,4-dimethyl-1H-pyrrol-2-yl)methyl]-4-methyl-1H-pyrrol-3-yl}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31N3O6
InChI InChI=1S/C26H31N3O6/c1-13-14(2)20(10-22-18(8-26(33)35-6)16(4)24(12-31)29-22)27-19(13)9-21-17(7-25(32)34-5)15(3)23(11-30)28-21/h11-12,27-29H,7-10H2,1-6H3
InChIKey NHLBXQZXEDQSNQ-UHFFFAOYSA-N
Molecular Weight 481.549 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c(Cc2c(c(C)c([nH]2)C=O)CC(=O)OC)[nH]1)C)C)CC(=O)OC)C)C=O
SPLASH splash10-0019-0071900000-d2d7a48189762cbfd745
Source of Spectrum H1-36-1569-5
Wiley ID 755285