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1-(5-(4-Isopropylthiazol-2-yl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl)ethanone
SpectraBase Compound ID 1gwicUXuB35
InChI InChI=1S/C16H16N4O4S/c1-9(2)13-8-25-15(17-13)14-18-19(10(3)21)16(24-14)11-4-6-12(7-5-11)20(22)23/h4-9,16H,1-3H3
InChIKey ALVJHEDTMZMMJG-UHFFFAOYSA-N
Mol Weight 360.39 g/mol
Molecular Formula C16H16N4O4S
Exact Mass 360.089226 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pZT9QVBMh
Name 1-(5-(4-Isopropylthiazol-2-yl)-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl)ethanone
Alternate Name(s) 1-[2-(4-nitrophenyl)-5-(4-propan-2-yl-2-thiazolyl)-2H-1,3,4-oxadiazol-3-yl]ethanone 1-[2-(4-nitrophenyl)-5-(4-propan-2-yl-1,3-thiazol-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N4O4S
InChI InChI=1S/C16H16N4O4S/c1-9(2)13-8-25-15(17-13)14-18-19(10(3)21)16(24-14)11-4-6-12(7-5-11)20(22)23/h4-9,16H,1-3H3
InChIKey ALVJHEDTMZMMJG-UHFFFAOYSA-N
Molecular Weight 360.388 g/mol
SMILES C1(=NN(C(=O)C)C(O1)c1ccc(N(=O)=O)cc1)c1nc(C(C)C)cs1
SPLASH splash10-03di-0009000000-60c37b5c0b2008f15386
Source of Spectrum F2-44-4746-7e
Wiley ID 1706334