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6-chlorothymol

View entire compound with spectra: 5 NMR, 6 FTIR, 2 UV-Vis, 4 MS (GC), and 2 Near IR

6-chlorothymol
SpectraBase Compound ID 6YrZoC3pDGt
InChI InChI=1S/C10H13ClO/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6,12H,1-3H3
InChIKey KFZXVMNBUMVKLN-UHFFFAOYSA-N
Mol Weight 184.67 g/mol
Molecular Formula C10H13ClO
Exact Mass 184.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrK6rX1sC5R
Name Phenol, 4-chloro-5-methyl-2-(1-methylethyl)-
Alternate Name(s) Thymol, 6-chloro- 4-Chlor-2-isopropyl-5-methylphenol 4-Chloranyl-5-methyl-2-propan-2-yl-phenol 4-Chloro-2-isopropyl-5-methyl-phenol 4-Chloro-5-methyl-2-(1-methylethyl)phenol 4-Chloro-5-methyl-2-propan-2-ylphenol 4-Chloro-6-isopropyl-3-methylphenol 4-Chlorothymol 6-Chlorothymol Chlorothymol Chlorthymol AI3-00120 BRN 2084453 CASWELL NO. 216 EINECS 201-930-1 EPA PESTICIDE CHEMICAL CODE 080403 NSC 406261
CAS Registry Number 89-68-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13ClO
InChI InChI=1S/C10H13ClO/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6,12H,1-3H3
InChIKey KFZXVMNBUMVKLN-UHFFFAOYSA-N
Molecular Weight 184.666 g/mol
SMILES Oc1cc(c(cc1C(C)C)Cl)C
SPLASH splash10-014i-1900000000-afdb3b5e96f98ae598fd
Wiley ID 1472757