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2,6-Dichlorobenzonitrile
SpectraBase Compound ID GNk25A3kESE
InChI InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H
InChIKey YOYAIZYFCNQIRF-UHFFFAOYSA-N
Mol Weight 172.01 g/mol
Molecular Formula C7H3Cl2N
Exact Mass 170.964255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsxHiW3lX3r
Name Dichlobenil @
CAS Registry Number 1194-65-6
Classification Herbicide Antibiotic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 170.964254501 u
Formula C7H3Cl2N
InChI InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H
InChIKey YOYAIZYFCNQIRF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 172.014 g/mol
SMILES c1(c(C#N)c(ccc1)Cl)Cl
SPLASH splash10-00di-5900000000-d11b548aa4f09ecbe1c2
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 UHY UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Chlorthiamid artifact Dicloxacillin artifact-1
Technique GC/MS
Wiley ID MMPW6e_736