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3,5-Di-tert-butyl-7-(3,5-di-tert-butyl-2-hydroxy-phenyl)-1-methyl-1,3-dihydro-2H-azepin-2-one
SpectraBase Compound ID 5kU0fbR81cI
InChI InChI=1S/C29H45NO2/c1-26(2,3)18-14-20(24(31)21(15-18)28(7,8)9)23-17-19(27(4,5)6)16-22(29(10,11)12)25(32)30(23)13/h14-17,22,31H,1-13H3
InChIKey OPHKLMINBQFUSC-UHFFFAOYSA-N
Mol Weight 439.7 g/mol
Molecular Formula C29H45NO2
Exact Mass 439.34503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LNwMQOk5FiX
Name 3,5-Di-tert-butyl-7-(3,5-di-tert-butyl-2-hydroxy-phenyl)-1-methyl-1,3-dihydro-2H-azepin-2-one
CAS Registry Number 62743-86-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H45NO2
InChI InChI=1S/C29H45NO2/c1-26(2,3)18-14-20(24(31)21(15-18)28(7,8)9)23-17-19(27(4,5)6)16-22(29(10,11)12)25(32)30(23)13/h14-17,22,31H,1-13H3
InChIKey OPHKLMINBQFUSC-UHFFFAOYSA-N
Instrument Name Bruker WH-270
Literature Reference H.D. Becker, K. Gustafsson, J. Org. Chem. 42, 2966 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3