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3-Amino-2-(thiochroman-4-ylideneazo)-5-(4-nitrophenylazo)-thiazol-4-one
SpectraBase Compound ID 36cxetEdk0k
InChI InChI=1S/C18H15N7O3S2/c19-24-17(26)16(22-20-11-5-7-12(8-6-11)25(27)28)30-18(24)23-21-14-9-10-29-15-4-2-1-3-13(14)15/h1-8,20H,9-10,19H2
InChIKey XBVOICHXKWOFEJ-UHFFFAOYSA-N
Mol Weight 441.48 g/mol
Molecular Formula C18H15N7O3S2
Exact Mass 441.06778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOjsNsEn9aD
Name 3-Amino-2-(thiochroman-4-ylideneazo)-5-(4-nitrophenylazo)-thiazol-4-one
Appearance Green solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N7O3S2
InChI InChI=1S/C18H15N7O3S2/c19-24-17(26)16(22-20-11-5-7-12(8-6-11)25(27)28)30-18(24)23-21-14-9-10-29-15-4-2-1-3-13(14)15/h1-8,20H,9-10,19H2
InChIKey XBVOICHXKWOFEJ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2838
Molecular Weight 441.484 g/mol
SMILES NN1C(SC(=NNc2ccc(cc2)[N+]([O-])=O)C1=O)=NN=C1c2ccccc2SCC1
SPLASH splash10-03dl-3900200000-f3cf06c31624a3e4cc18
Source of Spectrum Y-54-2424-10e
Wiley ID 1878470