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N-Cyanoethyl-N-(2-carbomethoxyethyl)-4-(2-chloro-4-nitrophenylazo)aniline
SpectraBase Compound ID LmwSwjspx1A
InChI InChI=1S/C19H18ClN5O4/c1-29-19(26)9-12-24(11-2-10-21)15-5-3-14(4-6-15)22-23-18-8-7-16(25(27)28)13-17(18)20/h3-8,13H,2,9,11-12H2,1H3/b23-22+
InChIKey BMUXKUVOASOJKR-GHVJWSGMSA-N
Mol Weight 415.84 g/mol
Molecular Formula C19H18ClN5O4
Exact Mass 415.104732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jRPRj39xnP
Name N-Cyanoethyl-N-(2-carbomethoxyethyl)-4-(2-chloro-4-nitrophenylazo)aniline
Alternate Name(s) Methyl 3-[4-[(E)-(2-chloro-4-nitrophenyl)diazenyl](2-cyanoethyl)anilino]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClN5O4
InChI InChI=1S/C19H18ClN5O4/c1-29-19(26)9-12-24(11-2-10-21)15-5-3-14(4-6-15)22-23-18-8-7-16(25(27)28)13-17(18)20/h3-8,13H,2,9,11-12H2,1H3/b23-22+
InChIKey BMUXKUVOASOJKR-GHVJWSGMSA-N
Molecular Weight 415.837 g/mol
SMILES c1(N(=O)=O)cc(Cl)c(\N=N\c2ccc(N(CCC(=O)OC)CCC#N)cc2)cc1
SPLASH splash10-0udj-9422300000-f2db3c0df0903437037e
Source of Spectrum IC-1135-0-0
Wiley ID 1375905