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Ethyl 3-[[(E)-5'-Chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(tert-butylamino)-2-butenoate
SpectraBase Compound ID D29N1LxM36Q
InChI InChI=1S/C16H21ClN4O5/c1-6-26-15(23)14(9(2)18-16(3,4)5)20-19-11-7-10(17)12(21(24)25)8-13(11)22/h7-8,18,22H,6H2,1-5H3/b14-9+,20-19+
InChIKey NAOSWOPVEJJYME-XKQAOIBWSA-N
Mol Weight 384.82 g/mol
Molecular Formula C16H21ClN4O5
Exact Mass 384.120047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4sCAKz5uCh
Name Ethyl 3-[[(E)-5'-Chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(tert-butylamino)-2-butenoate
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Formula C16H21ClN4O5
InChI InChI=1S/C16H21ClN4O5/c1-6-26-15(23)14(9(2)18-16(3,4)5)20-19-11-7-10(17)12(21(24)25)8-13(11)22/h7-8,18,22H,6H2,1-5H3/b14-9+,20-19+
InChIKey NAOSWOPVEJJYME-XKQAOIBWSA-N
Molecular Weight 384.820 g/mol
SMILES Oc1cc(c(cc1\N=N\C(=C\(NC(C)(C)C)C)C(=O)OCC)Cl)N(=O)=O
SPLASH splash10-0a4i-9144000000-aa8da8877beead07d965
Source of Spectrum J-62-1166-3
Synonyms Ethyl -[[(E)-5'-Chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(tert-butylamino)-2-butenoate Ethyl 2-[[(E)-5'-chloro-2'-hydroxy-4'-nitrophenyl]diazo]-3(E)-(tert-butylamino)-2-butenoate
Wiley ID 1361312