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Homoisophthaloyl dichloride
SpectraBase Compound ID 3QMqIJA63Nz
InChI InChI=1S/C9H6Cl2O2/c10-8(12)5-6-2-1-3-7(4-6)9(11)13/h1-4H,5H2
InChIKey PHTRRIQXFHZDQR-UHFFFAOYSA-N
Mol Weight 217.05 g/mol
Molecular Formula C9H6Cl2O2
Exact Mass 215.974485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XMTfm4oZwW
Name Homoisophthaloyl dichloride
Alternate Name(s) 3-(2-Chloro-2-oxoethyl)benzoyl chloride 3-(Chlorocarbonyl)benzeneacetyl chloride 3-[(Chlorocarbonyl)methyl]benzoyl chlride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6Cl2O2
InChI InChI=1S/C9H6Cl2O2/c10-8(12)5-6-2-1-3-7(4-6)9(11)13/h1-4H,5H2
InChIKey PHTRRIQXFHZDQR-UHFFFAOYSA-N
Molecular Weight 217.051 g/mol
SMILES C(c1cc(CC(=O)Cl)ccc1)(=O)Cl
SPLASH splash10-000t-0900000000-a928dede50716e53c391
Source of Spectrum H-82-753-1
Wiley ID 815483