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METACHROMIN_U
SpectraBase Compound ID 72NNOWOpACk
InChI InChI=1S/C22H30O3/c1-15-7-6-10-21(2,3)18(15)9-12-22(4)11-8-16-13-17(23)14-19(24-5)20(16)25-22/h8,11,13-14,18,23H,1,6-7,9-10,12H2,2-5H3
InChIKey OKZZLCIFQGFNCQ-UHFFFAOYSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C2mnGYqwMJG
Name METACHROMIN_U
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-15-7-6-10-21(2,3)18(15)9-12-22(4)11-8-16-13-17(23)14-19(24-5)20(16)25-22/h8,11,13-14,18,23H,1,6-7,9-10,12H2,2-5H3
InChIKey OKZZLCIFQGFNCQ-UHFFFAOYSA-N
Literature Reference Author S.P.B.OVENDEN,J.L.NIELSON,C.H.LIPTROT,R.H.WILLIS,D.M.TAPIOLA S,A.D.WRIGHT,C.A.MOT
Literature Reference Citation J.NAT.PROD.,74,1335(2011)
Literature Reference DOI 10.1021/np200041v
Molecular Weight 342.478 g/mol
Sample ID 38389
Solvent CD3OD