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2-n-Propylphenol
SpectraBase Compound ID GawxuxLtGnO
InChI InChI=1S/C9H12O/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7,10H,2,5H2,1H3
InChIKey LCHYEKKJCUJAKN-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLQPgvGwcP4
Name Phenol <2-propyl->
Source of Sample SAFC Cat.no. W352209
CAS Registry Number 644-35-9
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 136.088815005 u
Formula C9H12O
InChI InChI=1S/C9H12O/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7,10H,2,5H2,1H3
InChIKey LCHYEKKJCUJAKN-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
Number of Peaks 50
RI1 1221
RI2 899
RI3 1503
RI4 1462
SMILES Oc1ccccc1CCC
SPLASH splash10-0a4i-5900000000-b11aae11400cca11d3aa
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-propyl-
Wiley ID LM_FFNSC3_585