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2H-1,4-Benzoxazin-2-one, 3-[2-[3-(acetyloxy)-4-nitrophenyl]ethenyl]-7-(dimethylamino)-, (E)-
SpectraBase Compound ID KybyoftfW9A
InChI InChI=1S/C20H17N3O6/c1-12(24)28-19-10-13(5-9-17(19)23(26)27)4-7-16-20(25)29-18-11-14(22(2)3)6-8-15(18)21-16/h4-11H,1-3H3/b7-4+
InChIKey ASIODFONKKYDOU-QPJJXVBHSA-N
Mol Weight 395.37 g/mol
Molecular Formula C20H17N3O6
Exact Mass 395.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGOhtk5ah6p
Name 2H-1,4-Benzoxazin-2-one, 3-[2-[3-(acetyloxy)-4-nitrophenyl]ethenyl]-7-(dimethylamino)-, (E)-
CAS Registry Number 105074-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3O6
InChI InChI=1S/C20H17N3O6/c1-12(24)28-19-10-13(5-9-17(19)23(26)27)4-7-16-20(25)29-18-11-14(22(2)3)6-8-15(18)21-16/h4-11H,1-3H3/b7-4+
InChIKey ASIODFONKKYDOU-QPJJXVBHSA-N
Molecular Weight 395.371 g/mol
SMILES c1(N(=O)=O)c(OC(=O)C)cc(\C=C\C2=Nc3ccc(cc3OC2=O)N(C)C)cc1
SPLASH splash10-0006-9002000000-97636b6c5d6392196a4b
Source of Spectrum Y-22-1279-6
Synonyms 5-{(E)-2-[7-(dimethylamino)-2-oxo-2H-1,4-benzoxazin-3-yl]ethenyl}-2-nitrophenyl acetate 7-Dimethylamino-3-(4-acetoxy-4-nitrostyryl)-1,4-benzoxazin-2-one Acetic acid[5-[(E)-2-[7-(dimethylamino)-2-keto-1,4-benzoxazin-3-yl]vinyl]-2-nitro-phenyl]ester Acetic acid[5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]-2-nitrophenyl]ester [5-[(E)-2-[7-(dimethylamino)-2-oxidanylidene-1,4-benzoxazin-3-yl]ethenyl]-2-nitro-phenyl]ethanoate [5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]-2-nitrophenyl]acetate [5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]vinyl]-2-nitro-phenyl]acetate Acetic acid [5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]-2-nitrophenyl] ester [5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]ethenyl]-2-nitrophenyl] acetate [5-[(E)-2-[7-(dimethylamino)-2-oxo-1,4-benzoxazin-3-yl]vinyl]-2-nitro-phenyl] acetate [5-[(E)-2-[7-(dimethylamino)-2-oxidanylidene-1,4-benzoxazin-3-yl]ethenyl]-2-nitro-phenyl] ethanoate
Wiley ID 1367004