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5-tert-Butyl-2-(3,4,5-trichlorophenyl)isoindoline-1,3-dione
SpectraBase Compound ID CPZJoa98Rv5
InChI InChI=1S/C18H14Cl3NO2/c1-18(2,3)9-4-5-11-12(6-9)17(24)22(16(11)23)10-7-13(19)15(21)14(20)8-10/h4-8H,1-3H3
InChIKey ZRXYOWQFZOBFSN-UHFFFAOYSA-N
Mol Weight 382.67 g/mol
Molecular Formula C18H14Cl3NO2
Exact Mass 381.009012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTQhYzgFKfg
Name 5-tert-Butyl-2-(3,4,5-trichlorophenyl)isoindoline-1,3-dione
Alternate Name(s) 5-tert-butyl-2-(3,4,5-trichlorophenyl)isoindole-1,3-dione 5-tert-butyl-2-[3,4,5-tris(chloranyl)phenyl]isoindole-1,3-dione
Comments Less than 3 mono-isotopic peaks
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Formula C18H14Cl3NO2
InChI InChI=1S/C18H14Cl3NO2/c1-18(2,3)9-4-5-11-12(6-9)17(24)22(16(11)23)10-7-13(19)15(21)14(20)8-10/h4-8H,1-3H3
InChIKey ZRXYOWQFZOBFSN-UHFFFAOYSA-N
Molecular Weight 382.674 g/mol
SMILES C1(N(C(c2ccc(cc12)C(C)(C)C)=O)c1cc(Cl)c(c(c1)Cl)Cl)=O
SPLASH splash10-001i-0009000000-fcb635dd73c5449b2301
Source of Spectrum F2-45-1653-7c
Wiley ID 1703419