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

*Links on SpectraBase are not permalinks.
Ethyl 6-amino-5-cyano-2-methyl-4-phenylnicotinate
SpectraBase Compound ID 5tyYJiRYzzZ
InChI InChI=1S/C16H15N3O2/c1-3-21-16(20)13-10(2)19-15(18)12(9-17)14(13)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3,(H2,18,19)
InChIKey DTSKJUXDWVXEDG-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C16H15N3O2
Exact Mass 281.116427 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 8rK27hThAls
Name Ethyl 6-amino-5-cyano-2-methyl-4-phenylnicotinate
Appearance Faint yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O2
InChI InChI=1S/C16H15N3O2/c1-3-21-16(20)13-10(2)19-15(18)12(9-17)14(13)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3,(H2,18,19)
InChIKey DTSKJUXDWVXEDG-UHFFFAOYSA-N
Instrument Name GC-MS DFS Thermo
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.11
Molecular Weight 281.315 g/mol
Reported Formula C16H15N3O2
SMILES Nc1c(c(c(c(n1)C)C(OCC)=O)-c1ccccc1)C#N
SPLASH splash10-000i-0190000000-68784dc71905f0d4f792
Source of Spectrum BJO-10-SM9-31b
Wiley ID 1853870