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4-Benzoyl-5,5a,6,6a,7,8-hexahydro-8-imino-4H-indolo[6,5,4-cd]indolinium acetate
SpectraBase Compound ID JwAbQmPfi0W
InChI InChI=1S/C20H17N3O.C2H4O2/c21-18-10-15-14-7-4-8-17-19(14)13(9-16(15)22-18)11-23(17)20(24)12-5-2-1-3-6-12;1-2(3)4/h1-8,10,13,16H,9,11H2,(H2,21,22);1H3,(H,3,4)
InChIKey HOPBFUJDHALMPG-UHFFFAOYSA-N
Mol Weight 375.43 g/mol
Molecular Formula C22H21N3O3
Exact Mass 375.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7J9nmYFyYfh
Name 4-Benzoyl-5,5a,6,6a,7,8-hexahydro-8-imino-4H-indolo[6,5,4-cd]indolinium acetate
Alternate Name(s) 4-Benzoyl-4,5,5a,6,6a,7-hexahydro-8H-indolo[6,5,4-cd]indol-8-imine acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N3O3
InChI InChI=1S/C20H17N3O.C2H4O2/c21-18-10-15-14-7-4-8-17-19(14)13(9-16(15)22-18)11-23(17)20(24)12-5-2-1-3-6-12;1-2(3)4/h1-8,10,13,16H,9,11H2,(H2,21,22);1H3,(H,3,4)
InChIKey HOPBFUJDHALMPG-UHFFFAOYSA-N
Molecular Weight 375.428 g/mol
SMILES OC(=O)C.N=C1C=C2c3c4c(N(CC4CC2N1)C(=O)c1ccccc1)ccc3
SPLASH splash10-0aor-3926000000-1ccd89443160918d034d
Source of Spectrum F-49-9523-17
Wiley ID 788396