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Ethyl 2-bromomethyl-6-cyano-7-ethoxy-5-phenyl-1,8-naphthyridine-3-carboxylate
SpectraBase Compound ID CYcRq0exUoQ
InChI InChI=1S/C21H18BrN3O3/c1-3-27-20-16(12-23)18(13-8-6-5-7-9-13)15-10-14(21(26)28-4-2)17(11-22)24-19(15)25-20/h5-10H,3-4,11H2,1-2H3
InChIKey JDYGEUGMIFVLIT-UHFFFAOYSA-N
Mol Weight 440.3 g/mol
Molecular Formula C21H18BrN3O3
Exact Mass 439.053154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13y12N6V4HX
Name Ethyl 2-bromomethyl-6-cyano-7-ethoxy-5-phenyl-1,8-naphthyridine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18BrN3O3
InChI InChI=1S/C21H18BrN3O3/c1-3-27-20-16(12-23)18(13-8-6-5-7-9-13)15-10-14(21(26)28-4-2)17(11-22)24-19(15)25-20/h5-10H,3-4,11H2,1-2H3
InChIKey JDYGEUGMIFVLIT-UHFFFAOYSA-N
Molecular Weight 440.297 g/mol
SMILES c12nc(OCC)c(c(c2cc(c(n1)CBr)C(=O)OCC)-c1ccccc1)C#N
SPLASH splash10-0ik9-0009100000-0ec70bbd431c03719f7c
Source of Spectrum O1-65-332-2
Wiley ID 1592972