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3-(p-Methoxyphenyl)naphtho[2,3-d]isothiazole-4,9-dione
SpectraBase Compound ID Kiqu8TYliBO
InChI InChI=1S/C18H11NO3S/c1-22-11-8-6-10(7-9-11)15-14-16(20)12-4-2-3-5-13(12)17(21)18(14)23-19-15/h2-9H,1H3
InChIKey RXJBRSHJEJTPKQ-UHFFFAOYSA-N
Mol Weight 321.35 g/mol
Molecular Formula C18H11NO3S
Exact Mass 321.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQY9ldV5cfs
Name 3-(p-Methoxyphenyl)naphtho[2,3-d]isothiazole-4,9-dione
Appearance Orange needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11NO3S
InChI InChI=1S/C18H11NO3S/c1-22-11-8-6-10(7-9-11)15-14-16(20)12-4-2-3-5-13(12)17(21)18(14)23-19-15/h2-9H,1H3
InChIKey RXJBRSHJEJTPKQ-UHFFFAOYSA-N
Instrument Name Kratos MS902/MS50TC
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.052
Molecular Weight 321.350 g/mol
SMILES COc1ccc(cc1)-c1nsc2c1C(c1c(C2=O)cccc1)=O
SPLASH splash10-00di-1129000000-7acbb676a390730db855
Source of Spectrum ARK-2013-383-17b
Wiley ID 1853498