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N-[2-[N,N-Dimethylamino)ethyl] 4-[N-methyl-N-(3-methylamino-4-nitropbenzyloxycarbonyl)amino]phenylaceamide hydrochloride
SpectraBase Compound ID 1GMVmU6hfY4
InChI InChI=1S/C22H29N5O5/c1-23-19-13-17(7-10-20(19)27(30)31)15-32-22(29)26(4)18-8-5-16(6-9-18)14-21(28)24-11-12-25(2)3/h5-10,13,23H,11-12,14-15H2,1-4H3,(H,24,28)
InChIKey MLAVUUCORJKQJE-UHFFFAOYSA-N
Mol Weight 443.5 g/mol
Molecular Formula C22H29N5O5
Exact Mass 443.216869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PLUYCe21Gp
Name N-[2-[N,N-Dimethylamino)ethyl] 4-[N-methyl-N-(3-methylamino-4-nitropbenzyloxycarbonyl)amino]phenylaceamide hydrochloride
Alternate Name(s) N-[2-[N,N-Dimethylamino)-ethyl]-4-[N-methyl-N-(3-methylamino-4-nitro-benzyloxycarbonyl)-amino]-phenylacetamide N-[4-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]phenyl]-N-methylcarbamic acid [3-(methylamino)-4-nitrophenyl]methyl ester [3-(methylamino)-4-nitrophenyl]methyl N-[4-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]phenyl]-N-methylcarbamate [3-(methylamino)-4-nitro-phenyl]methyl N-[4-[2-[2-(dimethylamino)ethylamino]-2-oxo-ethyl]phenyl]-N-methyl-carbamate [3-(methylamino)-4-nitro-phenyl]methyl N-[4-[2-[2-(dimethylamino)ethylamino]-2-oxidanylidene-ethyl]phenyl]-N-methyl-carbamate
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Formula C22H29N5O5
InChI InChI=1S/C22H29N5O5/c1-23-19-13-17(7-10-20(19)27(30)31)15-32-22(29)26(4)18-8-5-16(6-9-18)14-21(28)24-11-12-25(2)3/h5-10,13,23H,11-12,14-15H2,1-4H3,(H,24,28)
InChIKey MLAVUUCORJKQJE-UHFFFAOYSA-N
Molecular Weight 443.504 g/mol
SMILES N(C(Cc1ccc(N(C(OCc2ccc(c(c2)NC)N(=O)=O)=O)C)cc1)=O)CCN(C)C
SPLASH splash10-052r-0071900000-3e0d203bb94419cd4633
Source of Spectrum KC-0-2770-4
Wiley ID 829112