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2,6-Ditert-butyl-4-[(2,3,5-trifluoro-6-pyrrolidin-1-yl-4-pyridyl)sulfanyl]phenol
SpectraBase Compound ID B6XR2YBoLpH
InChI InChI=1S/C23H29F3N2OS/c1-22(2,3)14-11-13(12-15(18(14)29)23(4,5)6)30-19-16(24)20(26)27-21(17(19)25)28-9-7-8-10-28/h11-12,29H,7-10H2,1-6H3
InChIKey DULNJEIFPAZNLV-UHFFFAOYSA-N
Mol Weight 438.55 g/mol
Molecular Formula C23H29F3N2OS
Exact Mass 438.195269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8X55eDTzKsO
Name 2,6-Ditert-butyl-4-[(2,3,5-trifluoro-6-pyrrolidin-1-yl-4-pyridyl)sulfanyl]phenol
Alternate Name(s) 2,6-Ditert-butyl-4-[(2,3,5-trifluoro-6-pyrrolidino-4-pyridyl)thio]phenol 2,6-Ditert-butyl-4-[2,3,5-tris(fluoranyl)-6-pyrrolidin-1-yl-pyridin-4-yl]sulfanyl-phenol 2,6-Ditert-butyl-4-[[2,3,5-trifluoro-6-(1-pyrrolidinyl)-4-pyridinyl]thio]phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29F3N2OS
InChI InChI=1S/C23H29F3N2OS/c1-22(2,3)14-11-13(12-15(18(14)29)23(4,5)6)30-19-16(24)20(26)27-21(17(19)25)28-9-7-8-10-28/h11-12,29H,7-10H2,1-6H3
InChIKey DULNJEIFPAZNLV-UHFFFAOYSA-N
Molecular Weight 438.553 g/mol
SMILES Oc1c(cc(Sc2c(c(N3CCCC3)nc(c2F)F)F)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-052o-9600300000-7455b42140f6728dd223
Wiley ID 1464083