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5-tert-Butyl-m-xylene

View entire compound with spectra: 15 NMR, 6 FTIR, 1 Raman, 2 MS (GC), and 2 Near IR

5-tert-Butyl-m-xylene
SpectraBase Compound ID 8H2xB4hpW5s
InChI InChI=1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3
InChIKey FZSPYHREEHYLCB-UHFFFAOYSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GFktewk47KD
Name 1-tert-Butyl-3,5-dimethylbenzene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 233587
CAS Registry Number 98-19-1
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18
InChI 1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3
InChIKey FZSPYHREEHYLCB-UHFFFAOYSA-N
Molecular Weight 162.280 g/mol
Purity 98%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 5-tert-Butyl-m-xylene; sym.-tert-Butyl-m-xylene
Wiley ID SIAL_VP-FTIR_001959