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Tristearin
SpectraBase Compound ID 428anokWXIG
InChI InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3
InChIKey DCXXMTOCNZCJGO-UHFFFAOYSA-N
Mol Weight 891.5 g/mol
Molecular Formula C57H110O6
Exact Mass 890.830241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dOJ7EaJvee
Name OCTADECANOIC ACID, 1,2,3-PROPANETRIYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C57H110O6
InChI InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3
InChIKey DCXXMTOCNZCJGO-UHFFFAOYSA-N
Molecular Weight 890.8275
SMILES CCCCCCCCCCCCCCCCCC(OCC(COC(CCCCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCCCC)=O)=O
SPLASH splash10-0a4i-9323004000-732a7f13796f59001977
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany