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(2R,3R)-2-(2,4-difluorophenyl)-3-(4-(6-(isopropyloxy)pyridin-2-yl)piperazin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
SpectraBase Compound ID 5PIex6E3oA5
InChI InChI=1S/C24H30F2N6O2/c1-17(2)34-23-6-4-5-22(29-23)31-11-9-30(10-12-31)18(3)24(33,14-32-16-27-15-28-32)20-8-7-19(25)13-21(20)26/h4-8,13,15-18,33H,9-12,14H2,1-3H3/t18-,24-/m1/s1
InChIKey XCLSIKZSVDVASY-HOYKHHGWSA-N
Mol Weight 472.54 g/mol
Molecular Formula C24H30F2N6O2
Exact Mass 472.239831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUu2ouYrrLz
Name (2R,3R)-2-(2,4-difluorophenyl)-3-(4-(6-(isopropyloxy)pyridin-2-yl)piperazin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
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Formula C24H30F2N6O2
InChI InChI=1S/C24H30F2N6O2/c1-17(2)34-23-6-4-5-22(29-23)31-11-9-30(10-12-31)18(3)24(33,14-32-16-27-15-28-32)20-8-7-19(25)13-21(20)26/h4-8,13,15-18,33H,9-12,14H2,1-3H3/t18-,24-/m1/s1
InChIKey XCLSIKZSVDVASY-HOYKHHGWSA-N
Ionization Type EI
Molecular Weight 472.541 g/mol
SMILES O[C@](C[n]1ncnc1)([C@@](C)(N1CCN(CC1)c1cccc(n1)OC(C)C)[H])c1ccc(cc1F)F
SPLASH splash10-0002-0290000000-2c7a17d850c19b189d13
Source of Spectrum US20100144712A1
Wiley ID 1842367