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3-[(E)-5'-Chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(methylamino)-2-penten-2-one
SpectraBase Compound ID KETI5S33IsS
InChI InChI=1S/C12H13ClN4O4/c1-6(14-3)12(7(2)18)16-15-9-4-8(13)10(17(20)21)5-11(9)19/h4-5,14,19H,1-3H3/b12-6+,16-15+
InChIKey BDFMZNUXGIQCRA-JJDVLQJSSA-N
Mol Weight 312.71 g/mol
Molecular Formula C12H13ClN4O4
Exact Mass 312.062533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFPhYmxImwu
Name 3-[(E)-5'-Chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(methylamino)-2-penten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN4O4
InChI InChI=1S/C12H13ClN4O4/c1-6(14-3)12(7(2)18)16-15-9-4-8(13)10(17(20)21)5-11(9)19/h4-5,14,19H,1-3H3/b12-6+,16-15+
InChIKey BDFMZNUXGIQCRA-JJDVLQJSSA-N
Molecular Weight 312.713 g/mol
SMILES Oc1cc(c(cc1\N=N\C(=C\(NC)C)C(=O)C)Cl)N(=O)=O
SPLASH splash10-067i-9072000000-d7b4499189141a409330
Source of Spectrum J-62-1166-3
Wiley ID 1312860