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617121

Sigma-Aldrich

Glyceryl tri(octanoate-d15)

98 atom % D, 98% (CP)

Synonym(s):

Trioctanoin-d45 (tri-octyl-d45)

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About This Item

Empirical Formula (Hill Notation):
C27D45H5O6
Molecular Weight:
515.96
MDL number:
MFCD01074307
UNSPSC Code:
12352108
PubChem Substance ID:
329759661

isotopic purity

98 atom % D

Assay

98% (CP)

mol wt

515.06 by atom % calculation (98 atom % D)

mass shift

M+45

storage temp.

−20°C

SMILES string

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)OCC(COC(=O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])OC(=O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]

InChI

1S/C27H50O6/c1-4-7-10-13-16-19-25(28)31-22-24(33-27(30)21-18-15-12-9-6-3)23-32-26(29)20-17-14-11-8-5-2/h24H,4-23H2,1-3H3/i1D3,2D3,3D3,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2,20D2,21D2

InChI key

VLPFTAMPNXLGLX-PMCKLPPWSA-N

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD1364
TJ1910

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