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2-(6,6,6-Trichloro-4-(trifluoromethyl)hexyl)isoindoline-1,3-dione
SpectraBase Compound ID FJMeYMoXXwe
InChI InChI=1S/C15H13Cl3F3NO2/c16-14(17,18)8-9(15(19,20)21)4-3-7-22-12(23)10-5-1-2-6-11(10)13(22)24/h1-2,5-6,9H,3-4,7-8H2
InChIKey QALZYLCPNSRLFT-UHFFFAOYSA-N
Mol Weight 402.63 g/mol
Molecular Formula C15H13Cl3F3NO2
Exact Mass 400.996396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoNKD974fT2
Name 2-(6,6,6-Trichloro-4-(trifluoromethyl)hexyl)isoindoline-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13Cl3F3NO2
InChI InChI=1S/C15H13Cl3F3NO2/c16-14(17,18)8-9(15(19,20)21)4-3-7-22-12(23)10-5-1-2-6-11(10)13(22)24/h1-2,5-6,9H,3-4,7-8H2
InChIKey QALZYLCPNSRLFT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201900075
Molecular Weight 402.628 g/mol
SMILES c1cc2c(cc1)C(N(C2=O)CCCC(CC(Cl)(Cl)Cl)C(F)(F)F)=O
SPLASH splash10-03di-0900200000-51acb45d3972e53c069f
Source of Spectrum CJC-37-SM35-6a
Wiley ID 1819520