John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=F6ILTMUgbi3 SpectraBase Spectrum ID=2w9sW5I2FLm

(accessed ).
myo-inositol, hexaisobutyrate
SpectraBase Compound ID F6ILTMUgbi3
InChI InChI=1S/C30H48O12/c1-13(2)25(31)37-19-20(38-26(32)14(3)4)22(40-28(34)16(7)8)24(42-30(36)18(11)12)23(41-29(35)17(9)10)21(19)39-27(33)15(5)6/h13-24H,1-12H3/t19-,20-,21-,22+,23-,24-
InChIKey OYJSFYMHRSFWJW-HPEVMFQJSA-N
Mol Weight 600.7 g/mol
Molecular Formula C30H48O12
Exact Mass 600.314577 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2w9sW5I2FLm
Name myo-inositol, hexaisobutyrate
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Formula C30H48O12
InChI InChI=1S/C30H48O12/c1-13(2)25(31)37-19-20(38-26(32)14(3)4)22(40-28(34)16(7)8)24(42-30(36)18(11)12)23(41-29(35)17(9)10)21(19)39-27(33)15(5)6/h13-24H,1-12H3/t19-,20-,21-,22+,23-,24-
InChIKey OYJSFYMHRSFWJW-HPEVMFQJSA-N
Instrument Name Varian A-60
Sadtler NMR Number 10913M
Solvent CDCl3
SpectraBase Batch ID FnW2F86XdO6