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dibutyl cis-4-cyclohexane-1,2-dicarboxylate
SpectraBase Compound ID 5P7b8zxTBPl
InChI InChI=1S/C16H28O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h13-14H,3-12H2,1-2H3/t13-,14+
InChIKey ANSWCYTXKAIJOK-OKILXGFUSA-N
Mol Weight 284.4 g/mol
Molecular Formula C16H28O4
Exact Mass 284.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSE3LGp5ote
Name dibutyl cis-4-cyclohexane-1,2-dicarboxylate
Alternate Name(s) dibutyl (1R,2S)-cyclohexane-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O4
InChI InChI=1S/C16H28O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h13-14H,3-12H2,1-2H3/t13-,14+
InChIKey ANSWCYTXKAIJOK-OKILXGFUSA-N
Literature Reference DOI 10.1002/cssc.201800646
Molecular Weight 284.396 g/mol
SMILES C(=O)(OCCCC)[C@]1(CCCC[C@]1(C(=O)OCCCC)[H])[H]
SPLASH splash10-0a59-6910000000-fa170cf6a95c90cdd4e3
Source of Spectrum CSC-11-SM27-SM27_1
Wiley ID 1813579