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Dimethyl ceanothate
SpectraBase Compound ID BhImfTHxHkh
InChI InChI=1S/C32H50O5/c1-18(2)19-12-15-32(27(35)37-9)17-16-29(5)20(23(19)32)10-11-22-30(29,6)14-13-21-28(3,4)25(33)24(26(34)36-8)31(21,22)7/h19-25,33H,1,10-17H2,2-9H3
InChIKey OTJNVRIBONQVIF-UHFFFAOYSA-N
Mol Weight 514.7 g/mol
Molecular Formula C32H50O5
Exact Mass 514.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ENHBYYGZb7N
Name Dimethyl ceanothate
CAS Registry Number 31300-24-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H50O5
InChI InChI=1S/C32H50O5/c1-18(2)19-12-15-32(27(35)37-9)17-16-29(5)20(23(19)32)10-11-22-30(29,6)14-13-21-28(3,4)25(33)24(26(34)36-8)31(21,22)7/h19-25,33H,1,10-17H2,2-9H3
InChIKey OTJNVRIBONQVIF-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference E. Wenkert, G.V. Baddeley, I.R. Burfitt, Org. Magn. Resonance 11, 337 (1978).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3