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Diethyl 1,4-cyclohexane dicarboxylate
SpectraBase Compound ID Epmk9wOZqb6
InChI InChI=1S/C12H20O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h9-10H,3-8H2,1-2H3
InChIKey KRJHRNUTLDTSKY-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIohYF04MZG
Name Diethyl 1,4-cyclohexane dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h9-10H,3-8H2,1-2H3
InChIKey KRJHRNUTLDTSKY-UHFFFAOYSA-N
Instrument Name Agilent 7890A/5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201509149
Molecular Weight 228.288 g/mol
Quality 725
SMILES C1(CCC(CC1)C(OCC)=O)C(OCC)=O
SPLASH splash10-053r-7900000000-c97f0522b711b3937c07
Source of Spectrum ACI-55-SM14-8 (DOI: 10.1002/anie.201509149)
Wiley ID 1895127