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4-(3,5-DICHLOROPHENOXY)-3-NITROBENZYL ALCOHOL, alpha,alpha,alpha-TRIFLUORO-p-TOLUATE (ESTER)
SpectraBase Compound ID F5vfeLjSSmD
InChI InChI=1S/C21H12Cl2F3NO5/c22-15-8-16(23)10-17(9-15)32-19-6-1-12(7-18(19)27(29)30)11-31-20(28)13-2-4-14(5-3-13)21(24,25)26/h1-10H,11H2
InChIKey CDDQSLHDLBYDQX-UHFFFAOYSA-N
Mol Weight 486.23 g/mol
Molecular Formula C21H12Cl2F3NO5
Exact Mass 485.004462 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CkWLDpzWgCJ
Name 4-(3,5-DICHLOROPHENOXY)-3-NITROBENZYL ALCOHOL, alpha,alpha,alpha-TRIFLUORO-p-TOLUATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12Cl2F3NO5
InChI InChI=1S/C21H12Cl2F3NO5/c22-15-8-16(23)10-17(9-15)32-19-6-1-12(7-18(19)27(29)30)11-31-20(28)13-2-4-14(5-3-13)21(24,25)26/h1-10H,11H2
InChIKey CDDQSLHDLBYDQX-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 93-95C
Molecular Weight 486.23
Solvent Polysol; Reference=TMS; Temperature 297K