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2-tert-Butyl-5-Methylanisole

View entire compound with spectra: 12 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

2-tert-Butyl-5-Methylanisole
SpectraBase Compound ID CPU9pK5xv99
InChI InChI=1S/C12H18O/c1-9-6-7-10(12(2,3)4)11(8-9)13-5/h6-8H,1-5H3
InChIKey NFDFEFJTYRAHEM-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ERE3t5NFeB9
Name 2-tert-Butyl-5-Methylanisole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 255262
CAS Registry Number 88-40-4
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI 1S/C12H18O/c1-9-6-7-10(12(2,3)4)11(8-9)13-5/h6-8H,1-5H3
InChIKey NFDFEFJTYRAHEM-UHFFFAOYSA-N
Molecular Weight 178.280 g/mol
Purity 99%
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_VP-FTIR_002512