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ORCINOTRIOL
SpectraBase Compound ID IzNnD7107Rm
InChI InChI=1S/C9H12O3/c1-6(10)2-7-3-8(11)5-9(12)4-7/h3-6,10-12H,2H2,1H3/t6-/m1/s1
InChIKey AIISKGPIMSRMOR-ZCFIWIBFSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A0fPxmGqCuX
Name ORCINOTRIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6(10)2-7-3-8(11)5-9(12)4-7/h3-6,10-12H,2H2,1H3/t6-/m1/s1
InChIKey AIISKGPIMSRMOR-ZCFIWIBFSA-N
Literature Reference Author H.SHIGEMORI,M.TENMA,K.SHIMAZAKI,J.KOBAYASHI
Literature Reference Citation J.NAT.PROD.,61,696(1998)
Literature Reference DOI 10.1021/np980011u
Molecular Weight 168.192 g/mol
Solvent CD3OD
Source File Reference UWMZ556