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2-(4',6'-Bistrifluoromethyl-2'-pyrimidinyl)-4-hydroxytetrahydroisoquinoline
SpectraBase Compound ID 20WY5ehwnWM
InChI InChI=1S/C15H11F6N3O/c16-14(17,18)11-5-12(15(19,20)21)23-13(22-11)24-6-8-3-1-2-4-9(8)10(25)7-24/h1-5,10,25H,6-7H2
InChIKey IQTFCKRBKRQVFN-UHFFFAOYSA-N
Mol Weight 363.26 g/mol
Molecular Formula C15H11F6N3O
Exact Mass 363.080631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30ieO6ctUAd
Name 2-(4',6'-Bistrifluoromethyl-2'-pyrimidinyl)-4-hydroxytetrahydroisoquinoline
Alternate Name(s) 2-[4,6-bis(trifluoromethyl)-2-pyrimidinyl]-1,2,3,4-tetrahydro-4-isoquinolinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11F6N3O
InChI InChI=1S/C15H11F6N3O/c16-14(17,18)11-5-12(15(19,20)21)23-13(22-11)24-6-8-3-1-2-4-9(8)10(25)7-24/h1-5,10,25H,6-7H2
InChIKey IQTFCKRBKRQVFN-UHFFFAOYSA-N
Molecular Weight 363.263 g/mol
SMILES OC1CN(c2nc(C(F)(F)F)cc(n2)C(F)(F)F)Cc2ccccc12
SPLASH splash10-0006-0429000000-16983f9d73a03bbfe80e
Source of Spectrum KO-9-469-2
Wiley ID 1350125