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2,3,6-Trimethylphenol

View entire compound with spectra: 13 NMR, 7 FTIR, 1 Raman, and 11 MS (GC)

2,3,6-Trimethylphenol
SpectraBase Compound ID D1jQANkpHdQ
InChI InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3
InChIKey QQOMQLYQAXGHSU-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HPD0ArYtQqC
Name 2,3,6-Trimethylphenol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W396303
Lot Number 03296AJ
CAS Registry Number 2416-94-6
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3
InChIKey QQOMQLYQAXGHSU-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
Purity >=97%
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Between salts
Wiley ID SIAL_FF-FTIR_002076