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N-Methylamino-4-nitro-2-(12-chloro-1,4,7,10-tetraoxadodecyl)benzene

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N-Methylamino-4-nitro-2-(12-chloro-1,4,7,10-tetraoxadodecyl)benzene
SpectraBase Compound ID 8vIeSGl8TUc
InChI InChI=1S/C15H23ClN2O6/c1-17-14-3-2-13(18(19)20)12-15(14)24-11-10-23-9-8-22-7-6-21-5-4-16/h2-3,12,17H,4-11H2,1H3
InChIKey ADHSRMIRVPXJHO-UHFFFAOYSA-N
Mol Weight 362.81 g/mol
Molecular Formula C15H23ClN2O6
Exact Mass 362.124464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GR3Lgm0fDDT
Name N-Methylamino-4-nitro-2-(12-chloro-1,4,7,10-tetraoxadodecyl)benzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.124464163 u
Formula C15H23ClN2O6
InChI InChI=1S/C15H23ClN2O6/c1-17-14-3-2-13(18(19)20)12-15(14)24-11-10-23-9-8-22-7-6-21-5-4-16/h2-3,12,17H,4-11H2,1H3
InChIKey ADHSRMIRVPXJHO-UHFFFAOYSA-N
Molecular Weight 362.810 g/mol
SMILES C=1(N(=O)=O)C=C(OCCOCCOCCOCCCl)C(=CC1)NC