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AWOGQCSIVCQXBT-VUEDXXQZSA-N
SpectraBase Compound ID xaDgVjK54b
InChI InChI=1S/C21H22O6/c1-22-16-5-3-12(7-18(16)23-2)20-14-9-25-21(15(14)10-24-20)13-4-6-17-19(8-13)27-11-26-17/h3-8,14-15,20-21H,9-11H2,1-2H3/t14-,15-,20+,21+/m0/s1
InChIKey AWOGQCSIVCQXBT-VUEDXXQZSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6FIQaSFFkEN
Name (REL)-(7S,7'S,8R,8'R)-METHYLPIPERITOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-22-16-5-3-12(7-18(16)23-2)20-14-9-25-21(15(14)10-24-20)13-4-6-17-19(8-13)27-11-26-17/h3-8,14-15,20-21H,9-11H2,1-2H3/t14-,15-,20+,21+/m0/s1
InChIKey AWOGQCSIVCQXBT-VUEDXXQZSA-N
Literature Reference Author A.N.D.L.BATISTA,J.M.B.JUNIOR,S.N.LOPEZ,M.FURLAN,A.J.CAVALHEI RO,D.H.S.SILVA
Literature Reference Citation QUIM.NOVA,33,321(2010)
Literature Reference DOI 10.1590/s0100-40422010000200017
Molecular Weight 370.402 g/mol
Solvent CDCl3
Source File Reference UWBT11914