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2-(2-(4-(trifluoromethyl)phenyl)-7,8-dihydrocyclohepta[b]pyrrol-1(6H)-yl)isoindoline-1,3-dione
SpectraBase Compound ID 6TiurszFplw
InChI InChI=1S/C24H17F3N2O2/c25-24(26,27)17-12-10-15(11-13-17)21-14-16-6-2-1-3-9-20(16)28(21)29-22(30)18-7-4-5-8-19(18)23(29)31/h2,4-8,10-14H,1,3,9H2
InChIKey OSHDGSYLZDKQFT-UHFFFAOYSA-N
Mol Weight 422.41 g/mol
Molecular Formula C24H17F3N2O2
Exact Mass 422.124212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49d3a3NeJKf
Name 2-(2-(4-(trifluoromethyl)phenyl)-7,8-dihydrocyclohepta[b]pyrrol-1(6H)-yl)isoindoline-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17F3N2O2
InChI InChI=1S/C24H17F3N2O2/c25-24(26,27)17-12-10-15(11-13-17)21-14-16-6-2-1-3-9-20(16)28(21)29-22(30)18-7-4-5-8-19(18)23(29)31/h2,4-8,10-14H,1,3,9H2
InChIKey OSHDGSYLZDKQFT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol901649p
Molecular Weight 422.407 g/mol
SMILES C1=Cc2cc([n](N3C(c4c(C3=O)cccc4)=O)c2CCC1)-c1ccc(cc1)C(F)(F)F
SPLASH splash10-00fr-7980400000-46de428a3c968b701d7b
Source of Spectrum A1-11-4002/SM19-7c
Synonyms 2-[2-[4-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cyclohepta[b]pyrrol-1-yl]isoindoline-1,3-dione 2-[2-[4-(trifluoromethyl)phenyl]-7,8-dihydro-6H-cyclohepta[b]pyrrol-1-yl]isoindole-1,3-dione
Wiley ID 1757370