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2,6-Xylenol
SpectraBase Compound ID 3AwWxRXWQuz
InChI InChI=1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3
InChIKey NXXYKOUNUYWIHA-UHFFFAOYSA-N
Mol Weight 122.17 g/mol
Molecular Formula C8H10O
Exact Mass 122.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lrO4mYTq40
Name Xylenol <2,6->
Source of Sample SAFC Cat.no. W324906
CAS Registry Number 576-26-1
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 122.073164941 u
Formula C8H10O
InChI InChI=1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3
InChIKey NXXYKOUNUYWIHA-UHFFFAOYSA-N
Molecular Weight 122.167 g/mol
Number of Peaks 50
RI1 1105
RI2 780
RI3 1281
RI4 1237
RI5 1086
SMILES Oc1c(cccc1C)C
SPLASH splash10-05i0-7900000000-1def365c95e0705e7803
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, 2,6-dimethyl-
Wiley ID LM_FFNSC3_263