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1,3-Dipalmitin

View entire compound with spectra: 2 NMR, 2 FTIR, 1 Raman, and 4 MS (GC)

1,3-Dipalmitin
SpectraBase Compound ID CLE4XyntBRx
InChI InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-31-33(36)32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3
InChIKey GFAZGHREJPXDMH-UHFFFAOYSA-N
Mol Weight 568.9 g/mol
Molecular Formula C35H68O5
Exact Mass 568.506675 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9K2rqMygo6d
Name 1,3-Dipalmitin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 568.506675285 u
Formula C35H68O5
InChI InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-31-33(36)32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3
InChIKey GFAZGHREJPXDMH-UHFFFAOYSA-N
Molecular Weight 568.924 g/mol
SMILES OC(COC(CCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.98783