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5-Amino-3-methyl-4-[(4-phenylthiazol-2-yl)diazenyl]isoxazole
SpectraBase Compound ID JBjjlDFGEJW
InChI InChI=1S/C13H11N5OS/c1-8-11(12(14)19-18-8)16-17-13-15-10(7-20-13)9-5-3-2-4-6-9/h2-7H,14H2,1H3
InChIKey DPHISSFGMUXPPF-UHFFFAOYSA-N
Mol Weight 285.32 g/mol
Molecular Formula C13H11N5OS
Exact Mass 285.068431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lfl2zXkkGs9
Name 5-Amino-3-methyl-4-[(4-phenylthiazol-2-yl)diazenyl]isoxazole
Appearance Red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N5OS
InChI InChI=1S/C13H11N5OS/c1-8-11(12(14)19-18-8)16-17-13-15-10(7-20-13)9-5-3-2-4-6-9/h2-7H,14H2,1H3
InChIKey DPHISSFGMUXPPF-UHFFFAOYSA-N
Instrument Name Kratos MS equipment or Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2589
Molecular Weight 285.325 g/mol
SMILES Nc1c(c(no1)C)N=Nc1scc(n1)-c1ccccc1
SPLASH splash10-0a4i-9060000000-498bf63e5665ebd0f50e
Source of Spectrum Y-54-346-15
Thin-Layer Chromatography Rf = 0.6 (pet.ether (40-60)/ethyl acetate, 1:3)
Wiley ID 1877845