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1-Benzoyl-3,6-diphenyl-4,4a,7a,8-tetrahydropyrrolo[3,4-f]indazole-5,7-dione
SpectraBase Compound ID JwXB1jnQX79
InChI InChI=1S/C28H21N3O3/c32-26(19-12-6-2-7-13-19)31-24-17-22-21(16-23(24)25(29-31)18-10-4-1-5-11-18)27(33)30(28(22)34)20-14-8-3-9-15-20/h1-15,21-22H,16-17H2
InChIKey NIMHSBDVLFJHHC-UHFFFAOYSA-N
Mol Weight 447.49 g/mol
Molecular Formula C28H21N3O3
Exact Mass 447.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRlAtOLtUDw
Name 1-Benzoyl-3,6-diphenyl-4,4a,7a,8-tetrahydropyrrolo[3,4-f]indazole-5,7-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H21N3O3
InChI InChI=1S/C28H21N3O3/c32-26(19-12-6-2-7-13-19)31-24-17-22-21(16-23(24)25(29-31)18-10-4-1-5-11-18)27(33)30(28(22)34)20-14-8-3-9-15-20/h1-15,21-22H,16-17H2
InChIKey NIMHSBDVLFJHHC-UHFFFAOYSA-N
Molecular Weight 447.494 g/mol
SMILES c12[n](nc(c2CC2C(=O)N(C(C2C1)=O)c1ccccc1)-c1ccccc1)C(=O)c1ccccc1
SPLASH splash10-0ab9-0900100000-c2adb0217479e9010156
Source of Spectrum H1-37-976-15
Synonyms 1-Benzoyl-3,6-diphenyl-4,4a,7a,8-tetrahydropyrrol[3,4-f]indazole-5,7-quinone 3,6-Diphenyl-1-(phenylcarbonyl)-4,4a,7a,8-tetrahydropyrrolo[3,4-f]indazole-5,7-dione
Wiley ID 755803