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1-Chloro-2,4-bis(trifluoromethyl)benzene
SpectraBase Compound ID HqFr8Y48mhH
InChI InChI=1S/C8H3ClF6/c9-6-2-1-4(7(10,11)12)3-5(6)8(13,14)15/h1-3H
InChIKey XIVDTLKMHDHQCB-UHFFFAOYSA-N
Mol Weight 248.56 g/mol
Molecular Formula C8H3ClF6
Exact Mass 247.982747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HC9aCrCMbFU
Name 1-Chloro-2,4-bis(trifluoromethyl)benzene
Alternate Name(s) 1-Chloranyl-2,4-bis(trifluoromethyl)benzene
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Formula C8H3ClF6
InChI InChI=1S/C8H3ClF6/c9-6-2-1-4(7(10,11)12)3-5(6)8(13,14)15/h1-3H
InChIKey XIVDTLKMHDHQCB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol501967c
Molecular Weight 248.555 g/mol
SMILES c1(cc(c(Cl)cc1)C(F)(F)F)C(F)(F)F
SPLASH splash10-002b-1490000000-a86440c9f9a5332177f1
Source of Spectrum A1-16-4268/SMS21-arb7
Wiley ID 1751170