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Octadecanoic acid, 1,3-propanediyl ester
SpectraBase Compound ID JbeBqKN2kAC
InChI InChI=1S/C39H76O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-38(40)42-36-33-37-43-39(41)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-37H2,1-2H3
InChIKey UFASAALQMYZBEM-UHFFFAOYSA-N
Mol Weight 609.0 g/mol
Molecular Formula C39H76O4
Exact Mass 608.574361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdCiLMhGzCh
Name Octadecanoic acid, 1,3-propanediyl ester
Alternate Name(s) 3-(Stearoyloxy)propyl stearate 3-Octadecanoyloxypropyl octadecanoate Octadecanoic acid 3-(1-oxooctadecoxy)propyl ester stearic acid 3-stearoyloxypropyl ester Stearic acid, trimethylene ester
CAS Registry Number 17367-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H76O4
InChI InChI=1S/C39H76O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-38(40)42-36-33-37-43-39(41)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-37H2,1-2H3
InChIKey UFASAALQMYZBEM-UHFFFAOYSA-N
Molecular Weight 609.033 g/mol
SMILES C(OCCCOC(=O)CCCCCCCCCCCCCCCCC)(=O)CCCCCCCCCCCCCCCCC
SPLASH splash10-0adl-9303000000-206c5d9cd65e830a7de7
Source of Spectrum EP-4852-0-0
Wiley ID 1410794