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[4'-(Phenylazo)phenacyl] N-{[2,2-bis(ethoxycarbonyl)vinylamino](sec-butyl)methyl}carboxylate
SpectraBase Compound ID DZDYHCJtBS5
InChI InChI=1S/C28H33N3O7/c1-5-19(4)25(29-17-23(26(33)36-6-2)27(34)37-7-3)28(35)38-18-24(32)20-13-15-22(16-14-20)31-30-21-11-9-8-10-12-21/h8-17,19,25,29H,5-7,18H2,1-4H3/b31-30+
InChIKey HMEALUORRFNEGT-NVQSTNCTSA-N
Mol Weight 523.6 g/mol
Molecular Formula C28H33N3O7
Exact Mass 523.23185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14WSk2dNpF7
Name [4'-(Phenylazo)phenacyl] N-{[2,2-bis(ethoxycarbonyl)vinylamino](sec-butyl)methyl}carboxylate
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Formula C28H33N3O7
InChI InChI=1S/C28H33N3O7/c1-5-19(4)25(29-17-23(26(33)36-6-2)27(34)37-7-3)28(35)38-18-24(32)20-13-15-22(16-14-20)31-30-21-11-9-8-10-12-21/h8-17,19,25,29H,5-7,18H2,1-4H3/b31-30+
InChIKey HMEALUORRFNEGT-NVQSTNCTSA-N
Molecular Weight 523.586 g/mol
SMILES N(C=C(C(=O)OCC)C(=O)OCC)C(C(OCC(c1ccc(\N=N\c2ccccc2)cc1)=O)=O)C(CC)C
SPLASH splash10-06vi-7590100000-4b4ecda78d50fae39af4
Source of Spectrum Y4-90-134-5
Synonyms 4'-Phenylazophenacyl N-[2'',2''-bis(ethoxycarbonyl)vinylamino}-2-(sec-butyl)acetate 4'-Phenylazophenacyl {N-2'',2''-bis(ethoxycarbonyl)vinylamino}-2-(sec-butyl)acetate Diethyl 2-({(2-methylbutyl)[(2-oxo-2-{4-[(E)-phenyldiazenyl]phenyl}ethoxy)carbonyl]amino}methylene)malonate
Wiley ID 1550395