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2,2,2-Trifluoro-N-[4-(1-{[5-(4-methoxy-phenylazo)-4-methyl-thiazol-2-yl]-hydrazono}-ethyl)-phenyl]-acetamide
SpectraBase Compound ID BkR9K74MzUd
InChI InChI=1S/C21H19F3N6O2S/c1-12(14-4-6-15(7-5-14)26-19(31)21(22,23)24)27-30-20-25-13(2)18(33-20)29-28-16-8-10-17(32-3)11-9-16/h4-11H,1-3H3,(H,25,30)(H,26,31)
InChIKey NJOPZFZOLQZGBM-UHFFFAOYSA-N
Mol Weight 476.48 g/mol
Molecular Formula C21H19F3N6O2S
Exact Mass 476.12423 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrMUmQhfUbH
Name 2,2,2-Trifluoro-N-[4-(1-{[5-(4-methoxy-phenylazo)-4-methyl-thiazol-2-yl]-hydrazono}-ethyl)-phenyl]-acetamide
Appearance Red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.124229537 u
Formula C21H19F3N6O2S
InChI InChI=1S/C21H19F3N6O2S/c1-12(14-4-6-15(7-5-14)26-19(31)21(22,23)24)27-30-20-25-13(2)18(33-20)29-28-16-8-10-17(32-3)11-9-16/h4-11H,1-3H3,(H,25,30)(H,26,31)
InChIKey NJOPZFZOLQZGBM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2022.103782
Molecular Weight 476.478 g/mol
SMILES N(N=C(C1=CC=C(C=C1)NC(C(F)(F)F)=O)C)C=1SC(=C(N1)C)N=NC1=CC=C(C=C1)OC
SPLASH splash10-0300-0079800000-b070305c7dc2d2a8b5c8
Source of Spectrum AJC-15-SM12-7c (DOI: 10.1016/j.arabjc.2022.103782)
Wiley ID 1908077