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Methyl 8,9-benzo-2,3-butano-6-azabicyclo[3.2.2]nona-3,6,8-triene-7-carboxylate
SpectraBase Compound ID 9A5vsTWpsVr
InChI InChI=1S/C18H19NO2/c1-21-18(20)17-16-12-7-3-2-6-11(12)10-15(19-17)13-8-4-5-9-14(13)16/h4-5,8-10,12,15-16H,2-3,6-7H2,1H3/t12-,15-,16-/m1/s1
InChIKey HBCGMHYZXJPOMX-UHFFFAOYSA-N
Mol Weight 281.36 g/mol
Molecular Formula C18H19NO2
Exact Mass 281.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Q74lM8otUK
Name Methyl 8,9-benzo-2,3-butano-6-azabicyclo[3.2.2]nona-3,6,8-triene-7-carboxylate
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Formula C18H19NO2
InChI InChI=1S/C18H19NO2/c1-21-18(20)17-16-12-7-3-2-6-11(12)10-15(19-17)13-8-4-5-9-14(13)16/h4-5,8-10,12,15-16H,2-3,6-7H2,1H3/t12-,15-,16-/m1/s1
InChIKey HBCGMHYZXJPOMX-UHFFFAOYSA-N
Molecular Weight 281.355 g/mol
SMILES C1(=N[C@@]2(C=C3[C@]([C@@]1(c1c2cccc1)[H])(CCCC3)[H])[H])C(=O)OC
SPLASH splash10-00yl-2890000000-b50a395cee613ea15a16
Source of Spectrum U-1995-1602-3
Synonyms Methyl 17-azatetracyclo[7.6.2.0(2,7).0(10,15)]heptadeca-7,10,12,14,16-pentaene-16-carboxylate Methyl 8,9-benzo-2,3-butano-6-azabicyclo[3.2.2]nona-3,6,8-triene-7-dboxylate
Wiley ID 767426