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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpRZGnVMGlq
Name Phenol, 2,3,6-trimethyl-
Alternate Name(s) 1-Hydroxy-2,3,6-trimethylbenzene 2,3,6-Trimethylphenol 3-Hydroxypseudocumene EINECS 219-330-3 HSDB 5876 NSC 91509
CAS Registry Number 2416-94-6
Copyright Copyright © 2020-2024 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
SMILES Oc1c(C)c(ccc1C)C
SPLASH splash10-00dr-7900000000-cc90c931a58861ab36d7
Source of Spectrum W5-5009-0-0
Wiley ID 1136280