For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1H-Pyrrole-2-carboxylic acid, 5-[[5-(ethoxycarbonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrrol-2-yl]methyl]-4-(2-hydroxyethyl)-3-methyl-, phenylmethyl ester

View entire compound with spectra: 1 MS (GC)

1H-Pyrrole-2-carboxylic acid, 5-[[5-(ethoxycarbonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrrol-2-yl]methyl]-4-(2-hydroxyethyl)-3-methyl-, phenylmethyl ester
SpectraBase Compound ID I516xmWr9PT
InChI InChI=1S/C26H32N2O6/c1-4-33-26(32)24-20(11-13-30)16(2)21(27-24)14-22-19(10-12-29)17(3)23(28-22)25(31)34-15-18-8-6-5-7-9-18/h5-9,27-30H,4,10-15H2,1-3H3
InChIKey FYPAKKDQIJOJHK-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C26H32N2O6
Exact Mass 468.226037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CJabDcDMyAw
Name 1H-Pyrrole-2-carboxylic acid, 5-[[5-(ethoxycarbonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrrol-2-yl]methyl]-4-(2-hydroxyethyl)-3-methyl-, phenylmethyl ester
Alternate Name(s) Benzyl 3,4'-bis-(2-hydroxyethyl)-3,4'-dimethyl-5'-ethoxycarbonylpyrromethane-5-carboxylate benzyl 5-{[5-(ethoxycarbonyl)-4-(2-hydroxyethyl)-3-methyl-1H-pyrrol-2-yl]methyl}-4-(2-hydroxyethyl)-3-methyl-1H-pyrrole-2-carboxylate
CAS Registry Number 87377-75-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32N2O6
InChI InChI=1S/C26H32N2O6/c1-4-33-26(32)24-20(11-13-30)16(2)21(27-24)14-22-19(10-12-29)17(3)23(28-22)25(31)34-15-18-8-6-5-7-9-18/h5-9,27-30H,4,10-15H2,1-3H3
InChIKey FYPAKKDQIJOJHK-UHFFFAOYSA-N
Molecular Weight 468.550 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(CCO)c([nH]1)C(=O)OCC)C)CCO)C)C(OCc1ccccc1)=O
SPLASH splash10-0006-9004300000-b6c068ef5095b5b01716
Source of Spectrum F-39-1855-0
Wiley ID 1392419