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(1R*,3aR*,3bR*)-1,2,3b,4-Tetrahydro-1-tert-butyl-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*,3aR*,3bR*)-1,2,3b,4-Tetrahydro-1-tert-butyl-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 wHCKNO4JYb
InChI InChI=1S/C23H25N3O3/c1-21(2,3)15-12-17(27)22(4)18-14-10-11-16(23(15,18)22)26-20(29)24(19(28)25(14)26)13-8-6-5-7-9-13/h5-11,14-16,18H,12H2,1-4H3/t14?,15-,16?,18?,22?,23?/m0/s1
InChIKey QOVWVTUOPRKWAV-LNSQOTCPSA-N
Mol Weight 391.47 g/mol
Molecular Formula C23H25N3O3
Exact Mass 391.189592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXKEeSN6UDU
Name (1R*,3aR*,3bR*)-1,2,3b,4-Tetrahydro-1-tert-butyl-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
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25N3O3
InChI InChI=1S/C23H25N3O3/c1-21(2,3)15-12-17(27)22(4)18-14-10-11-16(23(15,18)22)26-20(29)24(19(28)25(14)26)13-8-6-5-7-9-13/h5-11,14-16,18H,12H2,1-4H3/t14?,15-,16?,18?,22?,23?/m0/s1
InChIKey QOVWVTUOPRKWAV-LNSQOTCPSA-N
Molecular Weight 391.471 g/mol
SMILES C123C(C(=O)C[C@]3(C(C)(C)C)[H])(C)C1C1N3N(C2C=C1)C(N(c1ccccc1)C3=O)=O
SPLASH splash10-02tc-3910000000-78b0ad7763d202dca21b
Source of Spectrum KC-0-4089-4
Synonyms (3S)-3-tert-butyl-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
Wiley ID 827023