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2-Benzoyl-3-(o-methoxyphenyl)-1,3-diazabicyclo[3.3.0]octane
SpectraBase Compound ID 2sclhMXbDyn
InChI InChI=1S/C20H22N2O2/c1-24-18-12-6-5-11-17(18)22-14-16-10-7-13-21(16)20(22)19(23)15-8-3-2-4-9-15/h2-6,8-9,11-12,16,20H,7,10,13-14H2,1H3/t16-,20+/m0/s1
InChIKey WWCZDIPAFHTLPD-OXJNMPFZSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z6mfuYUSEU
Name 2-Benzoyl-3-(o-methoxyphenyl)-1,3-diazabicyclo[3.3.0]octane
Alternate Name(s) (2R,5S)-2-Benzoyl-3-(o-methoxyphenyl)-1,3-diazabicyclo[3.3.0]octane [2-(2-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-3-yl](phenyl)methanone [(3R,7aS)-2-(2-methoxyphenyl)-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-yl]-phenylmethanone [(3R,7aS)-2-(2-methoxyphenyl)-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-yl]-phenyl-methanone
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Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-24-18-12-6-5-11-17(18)22-14-16-10-7-13-21(16)20(22)19(23)15-8-3-2-4-9-15/h2-6,8-9,11-12,16,20H,7,10,13-14H2,1H3/t16-,20+/m0/s1
InChIKey WWCZDIPAFHTLPD-OXJNMPFZSA-N
Molecular Weight 322.408 g/mol
SMILES [C@]1(N(C[C@@]2(CCCN12)[H])c1c(OC)cccc1)(C(=O)c1ccccc1)[H]
SPLASH splash10-0100-6896000000-13057111dd7ac9c5ecd6
Source of Spectrum KC-0-2135-13
Wiley ID 786373