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1-Hexadecanone, 1-(4-hexadecyl-2,5-dihydroxyphenyl)-

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1-Hexadecanone, 1-(4-hexadecyl-2,5-dihydroxyphenyl)-
SpectraBase Compound ID GmMjQ2rnYG7
InChI InChI=1S/C38H68O3/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34-32-38(41)35(33-37(34)40)36(39)31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h32-33,40-41H,3-31H2,1-2H3
InChIKey OFAKJLUUWSQHHQ-UHFFFAOYSA-N
Mol Weight 573.0 g/mol
Molecular Formula C38H68O3
Exact Mass 572.516846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LbGXAARGnnl
Name 1-Hexadecanone, 1-(4-hexadecyl-2,5-dihydroxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 572.516846047 u
Formula C38H68O3
InChI InChI=1S/C38H68O3/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34-32-38(41)35(33-37(34)40)36(39)31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h32-33,40-41H,3-31H2,1-2H3
InChIKey OFAKJLUUWSQHHQ-UHFFFAOYSA-N
Molecular Weight 572.959 g/mol
SMILES CCCCCCCCCCCCCCCCC1=CC(O)=C(C=C1O)C(=O)CCCCCCCCCCCCCCC