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

*Links on SpectraBase are not permalinks.
METHYL-5-CYANO-4-METHOXY-CARBONYLMETHYL-2-METHYL-PYRROLE-3-PROPANOATE
SpectraBase Compound ID LwBb9y4Cl19
InChI InChI=1S/C13H16N2O4/c1-8-9(4-5-12(16)18-2)10(6-13(17)19-3)11(7-14)15-8/h15H,4-6H2,1-3H3
InChIKey HLFOIIDPGBFRJG-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 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 DBT3QcaCa5P
Name 3-[5-cyano-4-(2-keto-2-methoxy-ethyl)-2-methyl-1H-pyrrol-3-yl]propionic acid methyl ester
Alternate Name(s) 3-[5-cyano-4-(2-methoxy-2-oxoethyl)-2-methyl-1H-pyrrol-3-yl]propanoic acid methyl ester Methyl 3-[5-cyano-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-1H-pyrrol-3-yl]propanoate Methyl 3-[5-cyano-4-(2-methoxy-2-oxo-ethyl)-2-methyl-1H-pyrrol-3-yl]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-8-9(4-5-12(16)18-2)10(6-13(17)19-3)11(7-14)15-8/h15H,4-6H2,1-3H3
InChIKey HLFOIIDPGBFRJG-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES [nH]1c(c(c(c1C#N)CC(=O)OC)CCC(=O)OC)C
SPLASH splash10-01qc-0970000000-e9a77408af6d4fd14cd6
Source of Spectrum KC-0-2638-11
Wiley ID 786691