John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=LPkO2jQJXcz SpectraBase Spectrum ID=2bgai1T1t5j

(accessed ).
ORIENTANOL-B
SpectraBase Compound ID LPkO2jQJXcz
InChI InChI=1S/C21H22O4/c1-12(2)4-5-13-8-16-19(10-18(13)23-3)24-11-17-15-7-6-14(22)9-20(15)25-21(16)17/h4,6-10,17,21-22H,5,11H2,1-3H3/t17-,21-/m0/s1
InChIKey FZFGGNNUYSILSL-UWJYYQICSA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bgai1T1t5j
Name ORIENTANOL-B
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-12(2)4-5-13-8-16-19(10-18(13)23-3)24-11-17-15-7-6-14(22)9-20(15)25-21(16)17/h4,6-10,17,21-22H,5,11H2,1-3H3/t17-,21-/m0/s1
InChIKey FZFGGNNUYSILSL-UWJYYQICSA-N
Literature Reference Author H.TANAKA,T.TANAKA,H.ETOH
Literature Reference Citation PHYTOCHEM.,47,475(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00596-7
Molecular Weight 338.403 g/mol
Solvent CDCl3
Source File Reference UWMS209
SpectraBase Batch ID HzaICqoTN1u