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Diclofenac
SpectraBase Compound ID 2db8Bxh4hLu
InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
InChIKey DCOPUUMXTXDBNB-UHFFFAOYSA-N
Mol Weight 296.15 g/mol
Molecular Formula C14H11Cl2NO2
Exact Mass 295.016684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRnzV20RSCm
Name Diclofenac
Carrier Gas Helium (1.0 ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.016683996 u
Formula C14H11Cl2NO2
GC Column DB5-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 150oC
InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
InChIKey DCOPUUMXTXDBNB-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name Thermo GCMS
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.201500450
Quality 933
SMILES N(C=1C(=CC=CC1Cl)Cl)C=1C=CC=CC1CC(O)=O
SPLASH splash10-03xv-1190000000-8cb066c7b57075336294
Sample Comments Benzeneacetic acid, 2-[(2,6-dichloropgenyl)amino]-
Source of Spectrum QE-21-SM11-DIK (DOI: 10.1002/chem.201500450)
Wiley ID 1910165