John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6ieROAZzagN SpectraBase Spectrum ID=1l4eq7FfYLY

(accessed ).
5-tert-butylisophthalic acid, diethyl ester
SpectraBase Compound ID 6ieROAZzagN
InChI InChI=1S/C16H22O4/c1-6-19-14(17)11-8-12(15(18)20-7-2)10-13(9-11)16(3,4)5/h8-10H,6-7H2,1-5H3
InChIKey BZHLXVKJKZXQIK-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1l4eq7FfYLY
Name 5-tert-BUTYLISOPHTHALIC ACID, DIETHYL ESTER
Source of Sample J. Voss, University of Hamburg, Hamburg, Germany
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-6-19-14(17)11-8-12(15(18)20-7-2)10-13(9-11)16(3,4)5/h8-10H,6-7H2,1-5H3
InChIKey BZHLXVKJKZXQIK-UHFFFAOYSA-N
Melting Point 81-83C
Molecular Weight 278.35
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
SpectraBase Batch ID DpDCoBuJdn8
Synonyms ISOPHTHALIC ACID, 5-tert-BUTYL-, DIETHYL ESTER