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Hydroxylated soybean oil glycolic

View entire compound with spectra: 1 NMR, and 2 FTIR

Hydroxylated soybean oil glycolic
SpectraBase Compound ID Jyg29T3zeeE
InChI InChI=1S/C64H116O16/c1-4-7-10-12-14-20-29-38-54(79-63(72)47-65)52(67)37-28-19-16-24-33-42-60(69)74-49-51(76-62(71)44-35-26-18-23-31-40-57-56(77-57)39-30-21-15-13-11-8-5-2)50-75-61(70)43-34-25-17-22-32-41-58-59(78-58)46-45-55(80-64(73)48-66)53(68)36-27-9-6-3/h51-59,65-68H,4-50H2,1-3H3
InChIKey LRIVIVXIBUZBRS-UHFFFAOYSA-N
Mol Weight 1141.6 g/mol
Molecular Formula C64H116O16
Exact Mass 1140.826338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 36GQvpWl3YB
Name Hydroxylated soybean oil glycolic
Comments Computed using HOSE algorithm
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Exact Mass 1140.826337639 u
Formula C64H116O16
InChI InChI=1S/C64H116O16/c1-4-7-10-12-14-20-29-38-54(79-63(72)47-65)52(67)37-28-19-16-24-33-42-60(69)74-49-51(76-62(71)44-35-26-18-23-31-40-57-56(77-57)39-30-21-15-13-11-8-5-2)50-75-61(70)43-34-25-17-22-32-41-58-59(78-58)46-45-55(80-64(73)48-66)53(68)36-27-9-6-3/h51-59,65-68H,4-50H2,1-3H3
InChIKey LRIVIVXIBUZBRS-UHFFFAOYSA-N
Molecular Weight 1141.616 g/mol
SMILES OCC(OC(C(CCCCCCCC(OCC(COC(CCCCCCCC1OC1CCC(OC(CO)=O)C(CCCCC)O)=O)OC(CCCCCCCC1C(CCCCCCCCC)O1)=O)=O)O)CCCCCCCCC)=O