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1-Acetyl-7,10-dimethoxy-20-nitro-1-aza-[4.4]metacyclophan-13-ene
SpectraBase Compound ID B7aprQzRjw5
InChI InChI=1S/C23H26N2O5/c1-16(26)24-13-7-11-19-15-20(29-2)14-18(23(19)30-3)9-5-4-8-17-10-6-12-21(24)22(17)25(27)28/h4,6,8,10,12,14-15H,5,7,9,11,13H2,1-3H3/b8-4-
InChIKey VWZKKLLJIXAINP-YWEYNIOJSA-N
Mol Weight 410.47 g/mol
Molecular Formula C23H26N2O5
Exact Mass 410.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRtgo6Hz4o8
Name 1-Acetyl-7,10-dimethoxy-20-nitro-1-aza-[4.4]metacyclophan-13-ene
Comments Less than 3 mono-isotopic peaks
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Formula C23H26N2O5
InChI InChI=1S/C23H26N2O5/c1-16(26)24-13-7-11-19-15-20(29-2)14-18(23(19)30-3)9-5-4-8-17-10-6-12-21(24)22(17)25(27)28/h4,6,8,10,12,14-15H,5,7,9,11,13H2,1-3H3/b8-4-
InChIKey VWZKKLLJIXAINP-YWEYNIOJSA-N
Molecular Weight 410.470 g/mol
SMILES c1(N(=O)=O)c2N(C(=O)C)CCCc3cc(cc(c3OC)CC\C=C/c1ccc2)OC
SPLASH splash10-03di-0100900000-3df9d4933aec7c8c9af8
Source of Spectrum U-1995-1833-17
Synonyms 2-acetyl-8,20-dimethoxy-19-nitro-2-azatricyclo[13.3.1.1(6,10)]icosa-1(19),6(20),7,9,13,15,17-heptaene
Wiley ID 767570