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

*Links on SpectraBase are not permalinks.

2-(1H-Pyrrol-3-ylmethylene)-malonic acid, diethyl ester

View entire compound with spectra: 2 MS (GC)

2-(1H-Pyrrol-3-ylmethylene)-malonic acid, diethyl ester
SpectraBase Compound ID 7fFUfYbKYKb
InChI InChI=1S/C12H15NO4/c1-3-16-11(14)10(12(15)17-4-2)7-9-5-6-13-8-9/h5-8,13H,3-4H2,1-2H3
InChIKey LODUKPNSQRBKJC-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 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 EFQBgLedM0I
Name 2-(1H-Pyrrol-3-ylmethylene)-malonic acid, diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-3-16-11(14)10(12(15)17-4-2)7-9-5-6-13-8-9/h5-8,13H,3-4H2,1-2H3
InChIKey LODUKPNSQRBKJC-UHFFFAOYSA-N
Molecular Weight 237.255 g/mol
SMILES [nH]1cc(cc1)C=C(C(OCC)=O)C(=O)OCC
SPLASH splash10-0006-9710000000-1760c46851000c8d9d60
Synonyms 2-(1H-pyrrol-3-ylmethylidene)propanedioic acid diethyl ester Diethyl 2-(1H-pyrrol-3-ylmethylene)malonate Diethyl 2-(1H-pyrrol-3-ylmethylene)propanedioate Diethyl 2-(1H-pyrrol-3-ylmethylidene)propanedioate
Wiley ID 1481128