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(E)-2-cyano-3-[3-ethoxy-4-[(4-methyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enamide
SpectraBase Compound ID BZH5LhOl3qU
InChI InChI=1S/C16H16N4O5/c1-3-23-15-7-11(6-12(8-17)16(18)21)4-5-14(15)24-9-13-10(2)19-25-20(13)22/h4-7H,3,9H2,1-2H3,(H2,18,21)/b12-6+
InChIKey LMUBTPGGVVGLOG-WUXMJOGZSA-N
Mol Weight 344.33 g/mol
Molecular Formula C16H16N4O5
Exact Mass 344.11207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zSfHLhNGmR
Name (E)-2-cyano-3-[3-ethoxy-4-[(4-methyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N4O5
InChI InChI=1S/C16H16N4O5/c1-3-23-15-7-11(6-12(8-17)16(18)21)4-5-14(15)24-9-13-10(2)19-25-20(13)22/h4-7H,3,9H2,1-2H3,(H2,18,21)/b12-6+
InChIKey LMUBTPGGVVGLOG-WUXMJOGZSA-N
Molecular Weight 344.327 g/mol
SMILES NC(\C(=C\c1ccc(c(c1)OCC)OCc1[n+](onc1C)[O-])C#N)=O
SPLASH splash10-0udi-9870000000-3061d7e6672e118290c9
Synonyms (E)-2-cyano-3-[3-ethoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]-2-propenamide (E)-2-cyano-3-[3-ethoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enamide (E)-2-cyano-3-[3-ethoxy-4-[(4-methyl-2-oxido-furazan-2-ium-3-yl)methoxy]phenyl]acrylamide
Wiley ID 1452298