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Methyl (4R,4aR,11bR)-2,3,4,4a,5,6,8,11b-octahydro-4,11b-dimethyl-9-propyl-1H-phenanthro[2,3-d]imidazole-4-carboxylate
SpectraBase Compound ID A63FBAveyRd
InChI InChI=1S/C22H30N2O2/c1-5-7-19-23-16-12-14-8-9-18-21(2,15(14)13-17(16)24-19)10-6-11-22(18,3)20(25)26-4/h12-13,18H,5-11H2,1-4H3,(H,23,24)/t18-,21+,22-/m1/s1
InChIKey CXCHDSMXQDGDDP-BVYCBKJFSA-N
Mol Weight 354.49 g/mol
Molecular Formula C22H30N2O2
Exact Mass 354.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51nYCP1plh0
Name Methyl (4R,4aR,11bR)-2,3,4,4a,5,6,8,11b-octahydro-4,11b-dimethyl-9-propyl-1H-phenanthro[2,3-d]imidazole-4-carboxylate
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Formula C22H30N2O2
InChI InChI=1S/C22H30N2O2/c1-5-7-19-23-16-12-14-8-9-18-21(2,15(14)13-17(16)24-19)10-6-11-22(18,3)20(25)26-4/h12-13,18H,5-11H2,1-4H3,(H,23,24)/t18-,21+,22-/m1/s1
InChIKey CXCHDSMXQDGDDP-BVYCBKJFSA-N
Molecular Weight 354.494 g/mol
SMILES [nH]1c(nc2cc3c(cc12)CC[C@@]1([C@]3(CCC[C@]1(C(=O)OC)C)C)[H])CCC
SPLASH splash10-004i-0094000000-fa5b07b8712b22ee3016
Source of Spectrum KC-57-1797-4
Synonyms Methyl (4R,4aR,11bR)-4,11b-dimethyl-9-propyl-2,3,4,4a,5,6,8,11b-octahydro-1H-phenanthro[2,3-d]imidazole-4-carboxylate
Wiley ID 1623102