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1-Methyl-3-phenyl-6-(trifluoromethyl)isoquinoline
SpectraBase Compound ID B3JP9tE8Fdq
InChI InChI=1S/C17H12F3N/c1-11-15-8-7-14(17(18,19)20)9-13(15)10-16(21-11)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey DLJADARSFWEWLF-UHFFFAOYSA-N
Mol Weight 287.29 g/mol
Molecular Formula C17H12F3N
Exact Mass 287.092184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHE6VvqGqYq
Name 1-Methyl-3-phenyl-6-(trifluoromethyl)isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12F3N
InChI InChI=1S/C17H12F3N/c1-11-15-8-7-14(17(18,19)20)9-13(15)10-16(21-11)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey DLJADARSFWEWLF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201101009
Molecular Weight 287.285 g/mol
SMILES c1c(cc2c(c(C)nc(-c3ccccc3)c2)c1)C(F)(F)F
SPLASH splash10-000i-0190000000-4fc9271cd809ae787c2f
Source of Spectrum ASC-354-1890/SM10-9
Wiley ID 1762638