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Diethyl 5-hydroxyisophthalate
SpectraBase Compound ID LxDczrQDOKD
InChI InChI=1S/C12H14O5/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7,13H,3-4H2,1-2H3
InChIKey PUZBTHGPBGQFLW-UHFFFAOYSA-N
Mol Weight 238.24 g/mol
Molecular Formula C12H14O5
Exact Mass 238.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DE5IvokqpRX
Name Diethyl 5-hydroxyisophthalate
CAS Registry Number 39630-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O5
InChI InChI=1S/C12H14O5/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7,13H,3-4H2,1-2H3
InChIKey PUZBTHGPBGQFLW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol0625536
Molecular Weight 238.239 g/mol
SMILES Oc1cc(cc(C(=O)OCC)c1)C(OCC)=O
SPLASH splash10-0006-0920000000-543a04b91d584027e599
Source of Spectrum A1-8-5673/SM23-arb3
Synonyms 1,3-Benzenedicarboxylic acid, 5-hydroxy-, diethyl ester 5-Hydroxy-isophthalic acid diethyl ester 5-Hydroxybenzene-1,3-dicarboxylic acid diethyl ester Diethyl 5-hydroxybenzene-1,3-dicarboxylate Diethyl 5-oxidanylbenzene-1,3-dicarboxylate
Wiley ID 1760994