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3-Nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine
SpectraBase Compound ID 2eJAVKqLQV9
InChI InChI=1S/C20H13NO3S/c22-21(23)15-12-19-17(11-10-14-6-4-5-9-18(14)24-19)20(13-15)25-16-7-2-1-3-8-16/h1-13H
InChIKey LZKVZCSMIAEIAC-UHFFFAOYSA-N
Mol Weight 347.39 g/mol
Molecular Formula C20H13NO3S
Exact Mass 347.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKjh63TOpoy
Name 3-Nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13NO3S
InChI InChI=1S/C20H13NO3S/c22-21(23)15-12-19-17(11-10-14-6-4-5-9-18(14)24-19)20(13-15)25-16-7-2-1-3-8-16/h1-13H
InChIKey LZKVZCSMIAEIAC-UHFFFAOYSA-N
Molecular Weight 347.388 g/mol
SMILES c1ccc(Sc2c3C=Cc4c(Oc3cc(N(=O)=O)c2)cccc4)cc1
SPLASH splash10-0002-3889000000-8710a928dffcbffa2f23
Synonyms 2-Nitro-4-(phenylthio)benzo[b][1]benzoxepin 2-Nitro-4-phenylsulfanyl-benzo[b][1]benzoxepine
Wiley ID 1511879