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trans-8,10-Bis(4-nitrophenyl)-7,11-dioxa-9-azatricyclo[7.2.1.0(1,6)]dodecane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

trans-8,10-Bis(4-nitrophenyl)-7,11-dioxa-9-azatricyclo[7.2.1.0(1,6)]dodecane
SpectraBase Compound ID H22uw6juvDR
InChI InChI=1S/C21H21N3O6/c25-23(26)16-8-4-14(5-9-16)19-22-13-21(12-2-1-3-18(21)29-19)30-20(22)15-6-10-17(11-7-15)24(27)28/h4-11,18-20H,1-3,12-13H2/t18-,19+,20+,21+/m0/s1
InChIKey VGLQJDMWQQDYKD-DOIPELPJSA-N
Mol Weight 411.41 g/mol
Molecular Formula C21H21N3O6
Exact Mass 411.143035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L137uaaGfQb
Name trans-8,10-Bis(4-nitrophenyl)-7,11-dioxa-9-azatricyclo[7.2.1.0(1,6)]dodecane
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Formula C21H21N3O6
InChI InChI=1S/C21H21N3O6/c25-23(26)16-8-4-14(5-9-16)19-22-13-21(12-2-1-3-18(21)29-19)30-20(22)15-6-10-17(11-7-15)24(27)28/h4-11,18-20H,1-3,12-13H2/t18-,19+,20+,21+/m0/s1
InChIKey VGLQJDMWQQDYKD-DOIPELPJSA-N
Molecular Weight 411.414 g/mol
SMILES [C@@]1(N2C[C@@]3(O1)[C@](CCCC3)(O[C@@]2(c1ccc(N(=O)=O)cc1)[H])[H])(c1ccc(N(=O)=O)cc1)[H]
SPLASH splash10-01pk-0092300000-15558063b26fcca992eb
Source of Spectrum F-68-2182-19
Synonyms (1R,6S,8R,10R)-8,10-bis(4-nitrophenyl)-7,11-dioxa-9-azatricyclo[7.2.1.0(1,6)]dodecane
Wiley ID 1572015