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4-chloro-2,3,6-trimethylphenol
SpectraBase Compound ID 4w30YhznNCg
InChI InChI=1S/C9H11ClO/c1-5-4-8(10)6(2)7(3)9(5)11/h4,11H,1-3H3
InChIKey XNQJHONAJJVDKU-UHFFFAOYSA-N
Mol Weight 170.64 g/mol
Molecular Formula C9H11ClO
Exact Mass 170.049843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27X08vnSx69
Name Phenol, 4-chloro-2,3,6-trimethyl-
CAS Registry Number 36433-51-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11ClO
InChI InChI=1S/C9H11ClO/c1-5-4-8(10)6(2)7(3)9(5)11/h4,11H,1-3H3
InChIKey XNQJHONAJJVDKU-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c2gc16508b
Molecular Weight 170.639 g/mol
SMILES Oc1c(cc(c(c1C)C)Cl)C
SPLASH splash10-00dr-0900000000-6cd97140819d3d5c63c3
Source of Spectrum GCH-14-1673/SM2-13b
Synonyms 4-Chloranyl-2,3,6-trimethyl-phenol 4-Chloro-2,3,6-trimethylphenol 4-Chloro-2,3,6-trimethyl-phenol
Wiley ID 1760707