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(p-hydroxyphenyl)acetonitrile, 3,5-dichlorobenzenesulfonate (ester)
SpectraBase Compound ID 927wbcmW2L7
InChI InChI=1S/C14H9Cl2NO3S/c15-11-7-12(16)9-14(8-11)21(18,19)20-13-3-1-10(2-4-13)5-6-17/h1-4,7-9H,5H2
InChIKey NGZOILUZZNNHOC-UHFFFAOYSA-N
Mol Weight 342.2 g/mol
Molecular Formula C14H9Cl2NO3S
Exact Mass 340.96802 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JOMPmYnfWYK
Name (p-HYDROXYPHENYL)ACETONITRILE, 3,5-DICHLOROBENZENESULFONATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9Cl2NO3S
InChI InChI=1S/C14H9Cl2NO3S/c15-11-7-12(16)9-14(8-11)21(18,19)20-13-3-1-10(2-4-13)5-6-17/h1-4,7-9H,5H2
InChIKey NGZOILUZZNNHOC-UHFFFAOYSA-N
Melting Point 81-83C
Molecular Weight 342.20
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ACETONITRILE, /P-HYDROXYPHENYL/-, 3,5-DICHLOROBENZENESULFONATE (ESTER)