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Glyceryl tri(3,3-dideuteriopentadecanoate)
SpectraBase Compound ID GWaRsboG6Vz
InChI InChI=1S/C48H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-46(49)52-43-45(54-48(51)42-39-36-33-30-27-24-21-18-15-12-9-6-3)44-53-47(50)41-38-35-32-29-26-23-20-17-14-11-8-5-2/h45H,4-44H2,1-3H3/i37D2,38D2,39D2
InChIKey CLJLWABDLPQTHL-PMSKCOJYSA-N
Mol Weight 771.3 g/mol
Molecular Formula C48H862D6O6
Exact Mass 770.727051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNC3ni4aabb
Name Glyceryl tri(3,3-dideuteriopentadecanoate)
CAS Registry Number 30719-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H86D6O6
InChI InChI=1S/C48H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-46(49)52-43-45(54-48(51)42-39-36-33-30-27-24-21-18-15-12-9-6-3)44-53-47(50)41-38-35-32-29-26-23-20-17-14-11-8-5-2/h45H,4-44H2,1-3H3/i37D2,38D2,39D2
InChIKey CLJLWABDLPQTHL-PMSKCOJYSA-N
Molecular Weight 771.295 g/mol
SMILES C(OC(COC(=O)CC(CCCCCCCCCCCC)([2D])[2D])COC(=O)CC(CCCCCCCCCCCC)([2D])[2D])(=O)CC(CCCCCCCCCCCC)([2D])[2D]
SPLASH splash10-004i-9232130000-767879c3cdde597dc7ce
Source of Spectrum HO-0-1692-0
Wiley ID 66658