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meso-2,12-di(tert-butyl)-7,8,13a,13b-tetrahydro-6H-dipyrido[1,2-a:2',1'-c][1,4]diazepine
SpectraBase Compound ID B7Wtg19quAb
InChI InChI=1S/C21H32N2/c1-20(2,3)16-8-12-22-10-7-11-23-13-9-17(21(4,5)6)15-19(23)18(22)14-16/h8-9,12-15,18-19H,7,10-11H2,1-6H3/t18-,19+
InChIKey RWQAEHGDYAVKJO-KDURUIRLSA-N
Mol Weight 312.5 g/mol
Molecular Formula C21H32N2
Exact Mass 312.256549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9UJuExktD7
Name meso-2,12-di(tert-butyl)-7,8,13a,13b-tetrahydro-6H-dipyrido[1,2-a:2',1'-c][1,4]diazepine
Alternate Name(s) (13aR,13bS)-2,12-ditert-butyl-7,8,13a,13b-tetrahydro-6H-dipyrido[1,2-a:2,1-c][1,4]diazepine
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Formula C21H32N2
InChI InChI=1S/C21H32N2/c1-20(2,3)16-8-12-22-10-7-11-23-13-9-17(21(4,5)6)15-19(23)18(22)14-16/h8-9,12-15,18-19H,7,10-11H2,1-6H3/t18-,19+
InChIKey RWQAEHGDYAVKJO-KDURUIRLSA-N
Molecular Weight 312.501 g/mol
SMILES [C@]12([C@@]3(C=C(C(C)(C)C)C=CN3CCCN1C=CC(=C2)C(C)(C)C)[H])[H]
SPLASH splash10-004j-0901000000-1befd1f3d0f01dbb5e82
Source of Spectrum AJ-63-1420-6
Wiley ID 1313915