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(1R)-1,2,3b,4-Tetrahydro-1-ethyl-3a-methyl-7-phenyl-4,10-etheno-6H,10H-cyclopenta[1,3]cyclopropa[1,2-d][1,2,4]triazolo[1,2-a]pyridazine-3,6,8(3aH,7H)-trione

View entire compound with spectra: 1 MS (GC)

(1R)-1,2,3b,4-Tetrahydro-1-ethyl-3a-methyl-7-phenyl-4,10-etheno-6H,10H-cyclopenta[1,3]cyclopropa[1,2-d][1,2,4]triazolo[1,2-a]pyridazine-3,6,8(3aH,7H)-trione
SpectraBase Compound ID LbCe3QGzujs
InChI InChI=1S/C21H21N3O3/c1-3-12-11-16(25)20(2)17-14-9-10-15(21(12,17)20)24-19(27)22(18(26)23(14)24)13-7-5-4-6-8-13/h4-10,12,14-15,17H,3,11H2,1-2H3/t12-,14?,15?,17?,20?,21?/m1/s1
InChIKey IQFDYDRPHJDPPW-HOXFSVDISA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CldGATO2VoJ
Name (1R)-1,2,3b,4-Tetrahydro-1-ethyl-3a-methyl-7-phenyl-4,10-etheno-6H,10H-cyclopenta[1,3]cyclopropa[1,2-d][1,2,4]triazolo[1,2-a]pyridazine-3,6,8(3aH,7H)-trione
Alternate Name(s) (1R*,3aR*,3bS*)-1,2,3b,4-Tetrahydro-1-ethyl-3a-methyl-7-phenyl-4,10-etheno-6H,10H-cyclopenta[1,3]cyclopropa[1,2-d][1,2,4]triazolo[1,2-a]pyridazine-3,6,8(3aH,7H)-trione (3R)-3-ethyl-6-methyl-11-phenyl-9,11,13-triazapentacyclo[6.5.2.0(2,6).0(2,7).0(9,13)]pentadec-14-ene-5,10,12-trione
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Formula C21H21N3O3
InChI InChI=1S/C21H21N3O3/c1-3-12-11-16(25)20(2)17-14-9-10-15(21(12,17)20)24-19(27)22(18(26)23(14)24)13-7-5-4-6-8-13/h4-10,12,14-15,17H,3,11H2,1-2H3/t12-,14?,15?,17?,20?,21?/m1/s1
InChIKey IQFDYDRPHJDPPW-HOXFSVDISA-N
Molecular Weight 363.417 g/mol
SMILES C123C(C(=O)C[C@]3(CC)[H])(C)C1C1N3N(C2C=C1)C(N(c1ccccc1)C3=O)=O
SPLASH splash10-001i-0900000000-1aad0604bd9e2141ad23
Source of Spectrum KC-0-4088-4
Wiley ID 827026