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4-[5-(4-Fluorophenyl)isoxazol-4-yl]-2-isopropoxypyridine HCl
SpectraBase Compound ID 1pNhrCmHZ9n
InChI InChI=1S/C17H15FN2O2.ClH/c1-11(2)21-16-9-13(7-8-19-16)15-10-20-22-17(15)12-3-5-14(18)6-4-12;/h3-11H,1-2H3;1H
InChIKey RTBLORUWHKJNEC-UHFFFAOYSA-N
Mol Weight 334.78 g/mol
Molecular Formula C17H16ClFN2O2
Exact Mass 334.088434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ew7iK1VCa
Name 4-[5-(4-Fluorophenyl)isoxazol-4-yl]-2-isopropoxypyridine HCl
Alternate Name(s) 5-(4-fluorophenyl)-4-(2-isopropoxypyridin-4-yl)isoxazole hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16ClFN2O2
InChI InChI=1S/C17H15FN2O2.ClH/c1-11(2)21-16-9-13(7-8-19-16)15-10-20-22-17(15)12-3-5-14(18)6-4-12;/h3-11H,1-2H3;1H
InChIKey RTBLORUWHKJNEC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.200500025
Molecular Weight 334.778 g/mol
SMILES Cl.c1(ccc(-c2oncc2-c2ccnc(c2)OC(C)C)cc1)F
SPLASH splash10-059w-2490000000-ee141d6f62d8f181990d
Source of Spectrum CMC-1-204-9c
Wiley ID 1771456