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1,2,4-Trimethylbenzene
SpectraBase Compound ID 6xBPEjrhm7P
InChI InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3
InChIKey GWHJZXXIDMPWGX-UHFFFAOYSA-N
Mol Weight 120.19 g/mol
Molecular Formula C9H12
Exact Mass 120.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9yu8DW2kRC
Name Pseudocumene
CAS Registry Number 95-63-6
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 120.093900386 u
Formula C9H12
InChI InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3
InChIKey GWHJZXXIDMPWGX-UHFFFAOYSA-N
Molecular Weight 120.195 g/mol
Number of Peaks 50
RI1 1020
RI2 691
SMILES c1cc(c(cc1C)C)C
SPLASH splash10-0ab9-5900000000-9a845f34f53ed3fadf54
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 Benzene, 1,2,4-trimethyl-
Wiley ID LM_FFNSC3_1719