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

*Links on SpectraBase are not permalinks.
(8-acetoxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolyl) acetate
SpectraBase Compound ID 7jLXw3Z3UAF
InChI InChI=1S/C17H16N2O5/c1-5-22-16-9(2)15(23-10(3)20)12-6-7-19-13(8-18)14(12)17(16)24-11(4)21/h6-7H,5H2,1-4H3
InChIKey XZXHYOMHTOCUPG-UHFFFAOYSA-N
Mol Weight 328.32 g/mol
Molecular Formula C17H16N2O5
Exact Mass 328.105922 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 6t910q1HPSj
Name (8-acetoxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolyl) acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O5
InChI InChI=1S/C17H16N2O5/c1-5-22-16-9(2)15(23-10(3)20)12-6-7-19-13(8-18)14(12)17(16)24-11(4)21/h6-7H,5H2,1-4H3
InChIKey XZXHYOMHTOCUPG-UHFFFAOYSA-N
Molecular Weight 328.324 g/mol
SMILES c1(nccc2c(c(c(c(c12)OC(=O)C)OCC)C)OC(=O)C)C#N
SPLASH splash10-00ko-0090000000-90b0ff0c3dfacf5011ce
Source of Spectrum O1-63-2361-21
Synonyms (8-acetyloxy-1-cyano-7-ethoxy-6-methyl-isoquinolin-5-yl) ethanoate (8-acetyloxy-1-cyano-7-ethoxy-6-methylisoquinolin-5-yl) acetate Acetic acid (8-acetoxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolyl) ester Acetic acid (8-acetyloxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolinyl) ester
Wiley ID 1592903