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Stearic acid glycerol ester 2AC
SpectraBase Compound ID 5Wa83ZAu3Xp
InChI InChI=1S/C25H46O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h24H,4-21H2,1-3H3
InChIKey WSYNAKWAAXYNMW-UHFFFAOYSA-N
Mol Weight 442.6 g/mol
Molecular Formula C25H46O6
Exact Mass 442.329439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I5igpM1cOW
Name Stearic acid glycerol ester 2AC
CAS Registry Number 55401-62-2
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 442.329439195 u
Formula C25H46O6
InChI InChI=1S/C25H46O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h24H,4-21H2,1-3H3
InChIKey WSYNAKWAAXYNMW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 442.637 g/mol
Nominal Mass 442 u
Quality 997
Retention Index 3103
SMILES C(COC(CCCCCCCCCCCCCCCCC)=O)(OC(=O)C)COC(=O)C
SPLASH splash10-0a4i-7920000000-3d3e706ce860891499be
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,3-bis(acetyloxy)propyl octadecanoate
Technique GC/MS
Wiley ID DD2024_033324