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5-Chloro-2-(2,4-dichlorophenoxy)phenol
SpectraBase Compound ID 9IDTuW6rumF
InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
InChIKey XEFQLINVKFYRCS-UHFFFAOYSA-N
Mol Weight 289.55 g/mol
Molecular Formula C12H7Cl3O2
Exact Mass 287.951163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgTyuz8pjbc
Name Triclosan
CAS Registry Number 3380-34-5
Classification Antiseptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.951162563 u
Formula C12H7Cl3O2
InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
InChIKey XEFQLINVKFYRCS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 289.545 g/mol
SMILES c1(ccc(Oc2c(cc(cc2)Cl)Cl)c(c1)O)Cl
SPLASH splash10-03y4-7890000000-cb5f87193dc6ca92be25
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_691