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1-(2-Nitro-phenyl)-3-{3-[2-nitro-phenylimino]-propyl}-thiourea
SpectraBase Compound ID Lr3oolORmoY
InChI InChI=1S/C16H15N5O4S/c22-20(23)14-8-3-1-6-12(14)17-10-5-11-18-16(26)19-13-7-2-4-9-15(13)21(24)25/h1-4,6-10H,5,11H2,(H2,18,19,26)/b17-10+
InChIKey DSPYQLPYLOOUNY-LICLKQGHSA-N
Mol Weight 373.39 g/mol
Molecular Formula C16H15N5O4S
Exact Mass 373.084475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dmaoDGvICf
Name 1-(2-Nitro-phenyl)-3-{3-[2-nitro-phenylimino]-propyl}-thiourea
Alternate Name(s) N-(o-nitrophenyl)-N'[3''-(1''-o -nitroiminophenyl)propyl]thiourea (E)-1-(2-nitrophenyl)-3-(3-((2-nitrophenyl)imino)propyl)thiourea
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Formula C16H15N5O4S
InChI InChI=1S/C16H15N5O4S/c22-20(23)14-8-3-1-6-12(14)17-10-5-11-18-16(26)19-13-7-2-4-9-15(13)21(24)25/h1-4,6-10H,5,11H2,(H2,18,19,26)/b17-10+
InChIKey DSPYQLPYLOOUNY-LICLKQGHSA-N
Molecular Weight 373.387 g/mol
SMILES N(C(=S)NCC\C=N\c1c(N(=O)=O)cccc1)c1c(N(=O)=O)cccc1
SPLASH splash10-004i-0900000000-350f310266ffe2448fb8
Source of Spectrum EMC-37-840-10
Wiley ID 1734693