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N,N-Diethyl-3-methyl-4-(3-carboethoxy-5-nitrothien-2-ylazo)aniline
SpectraBase Compound ID JKRRINOeZ8f
InChI InChI=1S/C18H22N4O4S/c1-5-21(6-2)13-8-9-15(12(4)10-13)19-20-17-14(18(23)26-7-3)11-16(27-17)22(24)25/h8-11H,5-7H2,1-4H3/b20-19+
InChIKey XLWYCZQDZZMFFA-FMQUCBEESA-N
Mol Weight 390.46 g/mol
Molecular Formula C18H22N4O4S
Exact Mass 390.136176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HydMX0CWR3
Name N,N-Diethyl-3-methyl-4-(3-carboethoxy-5-nitrothien-2-ylazo)aniline
Alternate Name(s) Ethyl 2-{(E)-[4-(diethylamino)-2-methylphenyl]diazenyl}-5-nitro-3-thiophenecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N4O4S
InChI InChI=1S/C18H22N4O4S/c1-5-21(6-2)13-8-9-15(12(4)10-13)19-20-17-14(18(23)26-7-3)11-16(27-17)22(24)25/h8-11H,5-7H2,1-4H3/b20-19+
InChIKey XLWYCZQDZZMFFA-FMQUCBEESA-N
Molecular Weight 390.458 g/mol
SMILES c1(c(sc(c1)N(=O)=O)\N=N\c1c(cc(cc1)N(CC)CC)C)C(=O)OCC
SPLASH splash10-01r6-0609000000-0f3ed1ff4e113760fdb6
Source of Spectrum IC-1088-0-0
Wiley ID 1364638