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(+/-)-SAFROLE-2',3'-OXIDE;(+/-)-SFO
SpectraBase Compound ID KbbK0WfMrvs
InChI InChI=1S/C10H10O3/c1-2-9-10(13-6-12-9)4-7(1)3-8-5-11-8/h1-2,4,8H,3,5-6H2
InChIKey KZYXVVGEWCXONF-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CWtLmLtglV
Name (+/-)-SAFROLE-2',3'-OXIDE;(+/-)-SFO
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-2-9-10(13-6-12-9)4-7(1)3-8-5-11-8/h1-2,4,8H,3,5-6H2
InChIKey KZYXVVGEWCXONF-UHFFFAOYSA-N
Literature Reference Author L.C.SHEN,S.Y.CHIANG,I.T.HO,K.Y.WU,W.S.CHUNG
Literature Reference Citation EUR.J.ORG.CHEM.,2012,792(2012)
Literature Reference DOI 10.1002/ejoc.201101384
Molecular Weight 178.188 g/mol
Solvent CDCl3
Source File Reference UWLU85101