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(1E)-7-Chloro-10-hydroxy-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1,9(2H,10H)-acridinedione 1-(1H-benzimidazol-2-ylhydrazone)
SpectraBase Compound ID F1Fjd2euTTw
InChI InChI=1S/C27H19ClF3N5O2/c28-17-9-10-22-18(13-17)25(37)24-21(34-35-26-32-19-3-1-2-4-20(19)33-26)11-15(12-23(24)36(22)38)14-5-7-16(8-6-14)27(29,30)31/h1-10,13,15,38H,11-12H2,(H2,32,33,35)/b34-21+
InChIKey BOXNDNDEHIHFNE-KEIPNQJHSA-N
Mol Weight 537.93 g/mol
Molecular Formula C27H19ClF3N5O2
Exact Mass 537.117937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpP2as4KV8y
Name (1E)-7-Chloro-10-hydroxy-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1,9(2H,10H)-acridinedione 1-(1H-benzimidazol-2-ylhydrazone)
CAS Registry Number 102192-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H19ClF3N5O2
InChI InChI=1S/C27H19ClF3N5O2/c28-17-9-10-22-18(13-17)25(37)24-21(34-35-26-32-19-3-1-2-4-20(19)33-26)11-15(12-23(24)36(22)38)14-5-7-16(8-6-14)27(29,30)31/h1-10,13,15,38H,11-12H2,(H2,32,33,35)/b34-21+
InChIKey BOXNDNDEHIHFNE-KEIPNQJHSA-N
Molecular Weight 537.930 g/mol
SMILES N(\N=C\1C=2C(c3cc(ccc3N(C2CC(C1)c1ccc(cc1)C(F)(F)F)O)Cl)=O)c1nc2ccccc2[nH]1
SPLASH splash10-000i-0019000000-eac45974d056a8f35701
Source of Spectrum NP-15-9039-0
Synonyms 7-Chloro-3,4-dihydro-10-hydroxy-3-[4-[trifluoromethyl]phenyl]-1,9(2H,10H)-acridinedione, 1-(1H-benzimidazole-2-yl)hydrazone (1E)-1-(1H-benzimidazol-2-ylhydrazinylidene)-7-chloro-10-hydroxy-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one (1E)-1-(1H-benzimidazol-2-ylhydrazinylidene)-7-chloranyl-10-oxidanyl-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one
Wiley ID 1112975