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Benzoic acid, 4-[(acetylamino)(4-acetylaminofurazan-3-yl)methyleneaminooxymethyl]-, methyl ester
SpectraBase Compound ID AuBMFogVnoF
InChI InChI=1S/C16H17N5O6/c1-9(22)17-14(13-15(18-10(2)23)21-27-19-13)20-26-8-11-4-6-12(7-5-11)16(24)25-3/h4-7H,8H2,1-3H3,(H,17,20,22)(H,18,21,23)
InChIKey WMXQXFVKPHHVTC-UHFFFAOYSA-N
Mol Weight 375.34 g/mol
Molecular Formula C16H17N5O6
Exact Mass 375.117883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZIof7dI2ih
Name Benzoic acid, 4-[(acetylamino)(4-acetylaminofurazan-3-yl)methyleneaminooxymethyl]-, methyl ester
Alternate Name(s) 4-[[[(4-acetamido-1,2,5-oxadiazol-3-yl)-acetyliminomethyl]amino]oxymethyl]benzoic acid methyl ester 4-[[[C-(4-acetamidofurazan-3-yl)-N-acetyl-carbonimidoyl]amino]oxymethyl]benzoic acid methyl ester Methyl 4-[[[C-(4-acetamido-1,2,5-oxadiazol-3-yl)-N-acetyl-carbonimidoyl]amino]oxymethyl]benzoate Methyl 4-[[[C-(4-acetamido-1,2,5-oxadiazol-3-yl)-N-ethanoyl-carbonimidoyl]amino]oxymethyl]benzoate Methyl 4-{[({(Z)-(acetylamino)[4-(acetylamino)-1,2,5-oxadiazol-3-yl]methylidene}amino)oxy]methyl}benzoate
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Formula C16H17N5O6
InChI InChI=1S/C16H17N5O6/c1-9(22)17-14(13-15(18-10(2)23)21-27-19-13)20-26-8-11-4-6-12(7-5-11)16(24)25-3/h4-7H,8H2,1-3H3,(H,17,20,22)(H,18,21,23)
InChIKey WMXQXFVKPHHVTC-UHFFFAOYSA-N
Molecular Weight 375.341 g/mol
SMILES N(\C(c1c(non1)NC(=O)C)=N/OCc1ccc(C(=O)OC)cc1)C(=O)C
SPLASH splash10-0002-3901000000-0282c21a5b83a9462886
Wiley ID 1441621