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4'-chloro-m-toluaniline
SpectraBase Compound ID 8JuwsHf9uq1
InChI InChI=1S/C14H12ClNO/c1-10-3-2-4-11(9-10)14(17)16-13-7-5-12(15)6-8-13/h2-9H,1H3,(H,16,17)
InChIKey DDOSHRIGQWXMMY-UHFFFAOYSA-N
Mol Weight 245.71 g/mol
Molecular Formula C14H12ClNO
Exact Mass 245.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oUoCdeKBea
Name N-(4-Chlorophenyl)-3-methylbenzamide
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 245.060741709 u
Formula C14H12ClNO
InChI InChI=1S/C14H12ClNO/c1-10-3-2-4-11(9-10)14(17)16-13-7-5-12(15)6-8-13/h2-9H,1H3,(H,16,17)
InChIKey DDOSHRIGQWXMMY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 245.709 g/mol
Nominal Mass 245 u
Quality 985
Retention Index 2326
SMILES C(NC=1C=CC(=CC1)Cl)(C1=CC(=CC=C1)C)=O
SPLASH splash10-014i-4910000000-6c4c06fc84e3701c0fea
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-chlorophenyl)-3-methylbenzamide
Technique GC/MS
Wiley ID DD2024_025813