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1-(N-Methylamino)-2-(9'-hydroxy-1',4',7'-trioxanonyl)-4-nitrobenzene

View entire compound with spectra: 2 MS (GC)

1-(N-Methylamino)-2-(9'-hydroxy-1',4',7'-trioxanonyl)-4-nitrobenzene
SpectraBase Compound ID FjC0wRvKBUu
InChI InChI=1S/C13H20N2O6/c1-14-12-3-2-11(15(17)18)10-13(12)21-9-8-20-7-6-19-5-4-16/h2-3,10,14,16H,4-9H2,1H3
InChIKey KMRJQDUVWASRLC-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C13H20N2O6
Exact Mass 300.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BH9mWImZ1VP
Name 1-(N-Methylamino)-2-(9'-hydroxy-1',4',7'-trioxanonyl)-4-nitrobenzene
Alternate Name(s) 2-(2-{2-[2-(methylamino)-5-nitrophenoxy]ethoxy}ethoxy)ethanol N-Methylamino-4-nitro-2-(9-hydroxy-1,4,7-trioxanonyl)benzene 2-[2-[2-[2-(methylamino)-5-nitrophenoxy]ethoxy]ethoxy]ethanol
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Formula C13H20N2O6
InChI InChI=1S/C13H20N2O6/c1-14-12-3-2-11(15(17)18)10-13(12)21-9-8-20-7-6-19-5-4-16/h2-3,10,14,16H,4-9H2,1H3
InChIKey KMRJQDUVWASRLC-UHFFFAOYSA-N
Molecular Weight 300.311 g/mol
SMILES OCCOCCOCCOc1cc(ccc1NC)N(=O)=O
SPLASH splash10-0uy0-6904000000-03c69812ac3eba0bb664
Source of Spectrum QF-46-520-2
Wiley ID 833611