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Tributyl 2-acetylcitrate

View entire compound with spectra: 6 NMR, 11 FTIR, 1 Raman, and 7 MS (GC)

Tributyl 2-acetylcitrate
SpectraBase Compound ID 7zysIdSmt3a
InChI InChI=1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3
InChIKey QZCLKYGREBVARF-UHFFFAOYSA-N
Mol Weight 402.5 g/mol
Molecular Formula C20H34O8
Exact Mass 402.225368 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KFkFOspqAsK
Name Tributyl O-acetylcitrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 388378
CAS Registry Number 77-90-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O8
InChI InChI=1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3
InChIKey QZCLKYGREBVARF-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Tributyl 2-acetylcitrate; Acetyl tributyl citrate
Wiley ID SIAL_13CNMR_008463