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THREO-ANETHOLE-GLYCOL

View entire compound with spectra: 2 NMR, and 1 MS (GC)

THREO-ANETHOLE-GLYCOL
SpectraBase Compound ID 2RACmUE6H7a
InChI InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10+/m1/s1
InChIKey MRDZSBVJWOXBRW-XCBNKYQSSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3MmuBJjcG3
Name THREO-ANETHOLE-GLYCOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10+/m1/s1
InChIKey MRDZSBVJWOXBRW-XCBNKYQSSA-N
Literature Reference Author T.ISHIKAWA,E.FUJIMATU,J.KITAJIMA
Literature Reference Citation CHEM.PHARM.BULL.,50,1460(2002)
Literature Reference DOI 10.1248/cpb.50.1460
Molecular Weight 182.219 g/mol
Solvent C5D5N
Source File Reference UWMS20215