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

*Links on SpectraBase are not permalinks.
Ethyl 3,6-diamino-5-cyano-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
SpectraBase Compound ID 1isAfqUs2OX
InChI InChI=1S/C11H11N5O2/c1-2-18-11(17)8-7(13)6-3-5(4-12)9(14)16-10(6)15-8/h3H,2,13H2,1H3,(H3,14,15,16)
InChIKey ZHNYSKMUVZEKER-UHFFFAOYSA-N
Mol Weight 245.24 g/mol
Molecular Formula C11H11N5O2
Exact Mass 245.091275 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 J80qifcLPnB
Name Ethyl 3,6-diamino-5-cyano-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N5O2
InChI InChI=1S/C11H11N5O2/c1-2-18-11(17)8-7(13)6-3-5(4-12)9(14)16-10(6)15-8/h3H,2,13H2,1H3,(H3,14,15,16)
InChIKey ZHNYSKMUVZEKER-UHFFFAOYSA-N
Molecular Weight 245.242 g/mol
SMILES [nH]1c(c(c2cc(C#N)c(nc12)N)N)C(=O)OCC
SPLASH splash10-00di-0910000000-fb789f0cc2a2e29e5959
Source of Spectrum Y-48-595-12b
Synonyms ethyl 3,6-bis(azanyl)-5-cyano-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
Wiley ID 1667697