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Isoxazole, 5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-4-nitro-
SpectraBase Compound ID FD7WxxBotud
InChI InChI=1S/C13H12N2O4/c1-9-13(15(16)17)12(19-14-9)8-5-10-3-6-11(18-2)7-4-10/h3-8H,1-2H3/b8-5+
InChIKey YTRXYZQOCQHIMO-VMPITWQZSA-N
Mol Weight 260.25 g/mol
Molecular Formula C13H12N2O4
Exact Mass 260.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6l4BY8l05Pv
Name Isoxazole, 5-[2-(4-methoxyphenyl)ethenyl]-3-methyl-4-nitro-
Alternate Name(s) 5-[(E)-2-(4-methoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole 5-[(E)-2-(4-methoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole 5-[(E)-2-(4-methoxyphenyl)vinyl]-3-methyl-4-nitro-isoxazole
CAS Registry Number 53557-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O4
InChI InChI=1S/C13H12N2O4/c1-9-13(15(16)17)12(19-14-9)8-5-10-3-6-11(18-2)7-4-10/h3-8H,1-2H3/b8-5+
InChIKey YTRXYZQOCQHIMO-VMPITWQZSA-N
Molecular Weight 260.249 g/mol
SMILES c1(N(=O)=O)c(onc1C)\C=C\c1ccc(cc1)OC
SPLASH splash10-03di-0390000000-a88ab30bc1d302fcd59d
Source of Spectrum O-15-659-1
Wiley ID 1263495