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(E/Z)-N-[5-(3-Benzyloxy-5-nitro-1H-indazole-1-yl)-3-oxapentyl]-5-phenyl-4-pentenamine
SpectraBase Compound ID HxaOrilmjVu
InChI InChI=1S/C29H32N4O4/c34-33(35)26-15-16-28-27(22-26)29(37-23-25-13-6-2-7-14-25)31-32(28)19-21-36-20-18-30-17-9-3-8-12-24-10-4-1-5-11-24/h1-2,4-8,10-16,22,30H,3,9,17-21,23H2/b12-8+
InChIKey NSZYLHFYWHGHBV-XYOKQWHBSA-N
Mol Weight 500.6 g/mol
Molecular Formula C29H32N4O4
Exact Mass 500.242356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPw7FsjpusW
Name (E/Z)-N-[5-(3-Benzyloxy-5-nitro-1H-indazole-1-yl)-3-oxapentyl]-5-phenyl-4-pentenamine
Alternate Name(s) (E)-N-[2-[2-(5-nitro-3-phenylmethoxy-1-indazolyl)ethoxy]ethyl]-5-phenyl-4-penten-1-amine (E)-N-[2-[2-(5-nitro-3-phenylmethoxyindazol-1-yl)ethoxy]ethyl]-5-phenylpent-4-en-1-amine (E)-N-[2-[2-(3-benzyloxy-5-nitro-indazol-1-yl)ethoxy]ethyl]-5-phenyl-pent-4-en-1-amine (E)-N-[2-[2-(5-nitro-3-phenylmethoxy-indazol-1-yl)ethoxy]ethyl]-5-phenyl-pent-4-en-1-amine
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Formula C29H32N4O4
InChI InChI=1S/C29H32N4O4/c34-33(35)26-15-16-28-27(22-26)29(37-23-25-13-6-2-7-14-25)31-32(28)19-21-36-20-18-30-17-9-3-8-12-24-10-4-1-5-11-24/h1-2,4-8,10-16,22,30H,3,9,17-21,23H2/b12-8+
InChIKey NSZYLHFYWHGHBV-XYOKQWHBSA-N
Molecular Weight 500.599 g/mol
SMILES N(CCOCC[n]1c2c(c(n1)OCc1ccccc1)cc(N(=O)=O)cc2)CCC\C=C\c1ccccc1
SPLASH splash10-006x-8922010000-47a1374574bdc5c87939
Source of Spectrum F2-45-2162-34
Wiley ID 1689133