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3,5,5-trimethyl-1-hexanol, triester with boric acid
SpectraBase Compound ID ATRas3idyUs
InChI InChI=1S/C27H57BO3/c1-22(19-25(4,5)6)13-16-29-28(30-17-14-23(2)20-26(7,8)9)31-18-15-24(3)21-27(10,11)12/h22-24H,13-21H2,1-12H3
InChIKey OHWWMKMQGYSHNV-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C27H57BO3
Exact Mass 440.440076 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6b75LOK7eV3
Name 3,5,5-TRIMETHYL-1-HEXANOL, TRIESTER WITH BORIC ACID (H3BO3)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H57BO3
InChI InChI=1S/C27H57BO3/c1-22(19-25(4,5)6)13-16-29-28(30-17-14-23(2)20-26(7,8)9)31-18-15-24(3)21-27(10,11)12/h22-24H,13-21H2,1-12H3
InChIKey OHWWMKMQGYSHNV-UHFFFAOYSA-N
Molecular Weight 440.57
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BORIC ACID, TRIS/3,5,5-TRIMETHYL- HEXYL/ ESTER 1-HEXANOL, 3,5,5-TRIMETHYL-, TRIESTER WITH BORIC ACID