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Glutaric acid, 2,3-dichlorophenyl 2-nitrophenyl ester

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Glutaric acid, 2,3-dichlorophenyl 2-nitrophenyl ester
SpectraBase Compound ID 1goIURE7xVl
InChI InChI=1S/C17H13Cl2NO6/c18-11-5-3-8-14(17(11)19)26-16(22)10-4-9-15(21)25-13-7-2-1-6-12(13)20(23)24/h1-3,5-8H,4,9-10H2
InChIKey REOVEUZWALQAAY-UHFFFAOYSA-N
Mol Weight 398.2 g/mol
Molecular Formula C17H13Cl2NO6
Exact Mass 397.011993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dr6VGjbjuE
Name Glutaric acid, 2,3-dichlorophenyl 2-nitrophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 397.011992537 u
Formula C17H13Cl2NO6
InChI InChI=1S/C17H13Cl2NO6/c18-11-5-3-8-14(17(11)19)26-16(22)10-4-9-15(21)25-13-7-2-1-6-12(13)20(23)24/h1-3,5-8H,4,9-10H2
InChIKey REOVEUZWALQAAY-UHFFFAOYSA-N
Molecular Weight 398.198 g/mol
SMILES C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OC=1C=CC=CC1N(=O)=O)=O