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5-Nitroisoquinoline
SpectraBase Compound ID 56oZTXUEPYk
InChI InChI=1S/C9H6N2O2/c12-11(13)9-3-1-2-7-6-10-5-4-8(7)9/h1-6H
InChIKey PYGMPFQCCWBTJQ-UHFFFAOYSA-N
Mol Weight 174.16 g/mol
Molecular Formula C9H6N2O2
Exact Mass 174.042927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pbhAKwWP2
Name Isoquinoline, 5-nitro-
CAS Registry Number 607-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N2O2
InChI InChI=1S/C9H6N2O2/c12-11(13)9-3-1-2-7-6-10-5-4-8(7)9/h1-6H
InChIKey PYGMPFQCCWBTJQ-UHFFFAOYSA-N
Molecular Weight 174.159 g/mol
SMILES c1(N(=O)=O)c2c(ccc1)cncc2
SPLASH splash10-0g29-7900000000-492af5ed62c945a2a0d7
Source of Spectrum W5-1989-25645-1
Synonyms 5-Nitroisoquinoline AI3-61887 EINECS 210-133-8
Wiley ID 1170476