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1-Nitroisothioquinanthrene-7-oxide
SpectraBase Compound ID 74rKGyqgSeL
InChI InChI=1S/C18H9N3O3S2/c22-21(23)13-7-3-6-12-16(13)18-15(9-20-12)26(24)14-8-19-11-5-2-1-4-10(11)17(14)25-18/h1-9H
InChIKey RIQQEYULUGYJIX-UHFFFAOYSA-N
Mol Weight 379.41 g/mol
Molecular Formula C18H9N3O3S2
Exact Mass 379.008534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwwTQOmwJ1T
Name 1-Nitroisothioquinanthrene-7-oxide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H9N3O3S2
InChI InChI=1S/C18H9N3O3S2/c22-21(23)13-7-3-6-12-16(13)18-15(9-20-12)26(24)14-8-19-11-5-2-1-4-10(11)17(14)25-18/h1-9H
InChIKey RIQQEYULUGYJIX-UHFFFAOYSA-N
Molecular Weight 379.408 g/mol
SMILES c12S(c3c(Sc2c2c(N(=O)=O)cccc2nc1)c1ccccc1nc3)=O
SPLASH splash10-03di-0009000000-c7865530db52c23c1ff4
Source of Spectrum O1-60-1397-7
Wiley ID 1592080