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Glyceryl tridecanoate
SpectraBase Compound ID IIxdPuQJn6J
InChI InChI=1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3
InChIKey LADGBHLMCUINGV-UHFFFAOYSA-N
Mol Weight 554.9 g/mol
Molecular Formula C33H62O6
Exact Mass 554.45464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID XEwMhZF5MA
Name Glyceryl tridecanoate
Classification Fat
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Exact Mass 554.454639710 u
Formula C33H62O6
InChI InChI=1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3
InChIKey LADGBHLMCUINGV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 554.853 g/mol
SMILES C(CCCCCCCCC)(OC(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC)=O
SPLASH splash10-0a4i-9523000000-5c94905faa1567eeb52a
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: G
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_4466