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(2R,3R)-2-(2,4-difluorophenyl)-3-(4-(6-(2-morpholinoethoxy)pyridin-3-yl)piperazin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol

View entire compound with spectra: 1 MS (GC)

(2R,3R)-2-(2,4-difluorophenyl)-3-(4-(6-(2-morpholinoethoxy)pyridin-3-yl)piperazin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
SpectraBase Compound ID GFFPKOckg5v
InChI InChI=1S/C27H35F2N7O3/c1-21(27(37,18-36-20-30-19-32-36)24-4-2-22(28)16-25(24)29)34-6-8-35(9-7-34)23-3-5-26(31-17-23)39-15-12-33-10-13-38-14-11-33/h2-5,16-17,19-21,37H,6-15,18H2,1H3/t21-,27-/m1/s1
InChIKey NJTDFPUSYLQGHV-JIPXPUAJSA-N
Mol Weight 543.6 g/mol
Molecular Formula C27H35F2N7O3
Exact Mass 543.276944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnCKA5Mi32s
Name (2R,3R)-2-(2,4-difluorophenyl)-3-(4-(6-(2-morpholinoethoxy)pyridin-3-yl)piperazin-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H35F2N7O3
InChI InChI=1S/C27H35F2N7O3/c1-21(27(37,18-36-20-30-19-32-36)24-4-2-22(28)16-25(24)29)34-6-8-35(9-7-34)23-3-5-26(31-17-23)39-15-12-33-10-13-38-14-11-33/h2-5,16-17,19-21,37H,6-15,18H2,1H3/t21-,27-/m1/s1
InChIKey NJTDFPUSYLQGHV-JIPXPUAJSA-N
Ionization Type EI
Molecular Weight 543.620 g/mol
SMILES O[C@](C[n]1ncnc1)([C@@](C)(N1CCN(CC1)c1ccc(nc1)OCCN1CCOCC1)[H])c1ccc(cc1F)F
SPLASH splash10-014i-0209000000-7a44c673f2f63963652f
Source of Spectrum US20100144712A1
Wiley ID 1842378