For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

D-1,2-distearin

View entire compound with spectra: 2 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

D-1,2-distearin
SpectraBase Compound ID GnaAZwVZeTB
InChI InChI=1S/C39H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40H,3-36H2,1-2H3
InChIKey UHUSDOQQWJGJQS-UHFFFAOYSA-N
Mol Weight 625.0 g/mol
Molecular Formula C39H76O5
Exact Mass 624.569276 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CIOkkWcq3uf
Name D-1,2-Distearin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 624.569275542 u
Formula C39H76O5
InChI InChI=1S/C39H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40H,3-36H2,1-2H3
InChIKey UHUSDOQQWJGJQS-UHFFFAOYSA-N
Molecular Weight 625.032 g/mol
SMILES OCC(OC(CCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.985127