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N,N-Bis(2-acetoxyethyl)-3-methyl-4-(2,6-dinitro-3-carbamylphenylazo)-aniline
SpectraBase Compound ID Jaj1hOTdSQa
InChI InChI=1S/C22H24N6O9/c1-13-12-16(26(8-10-36-14(2)29)9-11-37-15(3)30)4-6-18(13)24-25-20-19(27(32)33)7-5-17(22(23)31)21(20)28(34)35/h4-7,12H,8-11H2,1-3H3,(H2,23,31)/b25-24+
InChIKey ZRBHOYNSESUOPX-OCOZRVBESA-N
Mol Weight 516.47 g/mol
Molecular Formula C22H24N6O9
Exact Mass 516.160476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWdCZgDogF1
Name N,N-Bis(2-acetoxyethyl)-3-methyl-4-(2,6-dinitro-3-carbamylphenylazo)-aniline
Alternate Name(s) 2-([2-(acetyloxy)ethyl]-4-{(E)-[3-(aminocarbonyl)-2,6-dinitrophenyl]diazenyl}-3-methylanilino)ethyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N6O9
InChI InChI=1S/C22H24N6O9/c1-13-12-16(26(8-10-36-14(2)29)9-11-37-15(3)30)4-6-18(13)24-25-20-19(27(32)33)7-5-17(22(23)31)21(20)28(34)35/h4-7,12H,8-11H2,1-3H3,(H2,23,31)/b25-24+
InChIKey ZRBHOYNSESUOPX-OCOZRVBESA-N
Molecular Weight 516.467 g/mol
SMILES NC(c1c(c(c(N(=O)=O)cc1)\N=N\c1c(cc(cc1)N(CCOC(=O)C)CCOC(=O)C)C)N(=O)=O)=O
SPLASH splash10-000f-9000000000-a94c8449cbb997440334
Source of Spectrum IC-1242-0-0
Wiley ID 1401355