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RADIRXJQODWKGQ-HWKANZROSA-N
SpectraBase Compound ID 3n1WGTGMy3U
InChI InChI=1S/C11H14O2/c1-3-5-9-6-7-11(13-4-2)10(12)8-9/h3,5-8,12H,4H2,1-2H3/b5-3+
InChIKey RADIRXJQODWKGQ-HWKANZROSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqCGX0RjZOd
Name Guaethol
Source of Sample SAFC Cat.no. W292206
CAS Registry Number 94-86-0
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 178.099379689 u
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-3-5-9-6-7-11(13-4-2)10(12)8-9/h3,5-8,12H,4H2,1-2H3/b5-3+
InChIKey RADIRXJQODWKGQ-HWKANZROSA-N
Molecular Weight 178.231 g/mol
Number of Peaks 50
RI1 1522
RI2 1198
SMILES Oc1c(ccc(c1)\C=C\C)OCC
SPLASH splash10-0fb9-5900000000-7ebd9acc59923cfc7b30
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Phenol, 2-ethoxy-5-(1-propenyl)-
Wiley ID LM_FFNSC3_819