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(3aR,9aR,9bS)-2-phenyl-6-[(1R)-1-phenylethyl]-3a,4,8,9,9a,9b-hexahydropyrrolo[3,4-f]quinoline-1,3,7-trione
SpectraBase Compound ID Fy1fo6QB9di
InChI InChI=1S/C25H24N2O3/c1-16(17-8-4-2-5-9-17)26-21-14-12-20-23(19(21)13-15-22(26)28)25(30)27(24(20)29)18-10-6-3-7-11-18/h2-11,14,16,19-20,23H,12-13,15H2,1H3/t16-,19+,20-,23+/m1/s1
InChIKey WQLFOGPRBAJDBK-WOSKWAQLSA-N
Mol Weight 400.48 g/mol
Molecular Formula C25H24N2O3
Exact Mass 400.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1W9mz4PXA95
Name (3aR,9aR,9bS)-2-phenyl-6-[(1R)-1-phenylethyl]-3a,4,8,9,9a,9b-hexahydropyrrolo[3,4-f]quinoline-1,3,7-trione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24N2O3
InChI InChI=1S/C25H24N2O3/c1-16(17-8-4-2-5-9-17)26-21-14-12-20-23(19(21)13-15-22(26)28)25(30)27(24(20)29)18-10-6-3-7-11-18/h2-11,14,16,19-20,23H,12-13,15H2,1H3/t16-,19+,20-,23+/m1/s1
InChIKey WQLFOGPRBAJDBK-WOSKWAQLSA-N
Molecular Weight 400.478 g/mol
SMILES C1(N(C2=CC[C@@]3([C@]([C@]2(CC1)[H])(C(N(C3=O)c1ccccc1)=O)[H])[H])[C@](C)(c1ccccc1)[H])=O
SPLASH splash10-0a4i-0900000000-47e67892698bed837fc6
Source of Spectrum F-68-6366-15
Wiley ID 1573203