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2,6-Ditert-butyl-4-[(2,3,5-trifluoro-6-pyrrolidin-1-yl-4-pyridyl)sulfanyl]phenol

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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

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GQjXRBVVLrw
Name phenol, 2,6-bis(1,1-dimethylethyl)-4-[[2,3,5-trifluoro-6-(1-pyrrolidinyl)-4-pyridinyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.195269224 u
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
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15706
Solvent DMSO-d6
Source Vendor ID: NMR/10301468; Lab Info: SIP; Lab Number: SIP-0025