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1,3-Dioctanoin
SpectraBase Compound ID HQ4zSHVywqS
InChI InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-15-17(20)16-24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3
InChIKey DMBAVJVECSKEPF-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C19H36O5
Exact Mass 344.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gIjwsW5Sb0
Name Glycerin dicaprylate
Alternate Name(s) 2-Hydroxypropane-1,3-diyl dioctanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O5
InChI InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-15-17(20)16-24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3
InChIKey DMBAVJVECSKEPF-UHFFFAOYSA-N
Molecular Weight 344.492 g/mol
SMILES OC(COC(=O)CCCCCCC)COC(=O)CCCCCCC
SPLASH splash10-004i-5910000000-9bc64785e4db3dd9e63e
Source of Spectrum JX-2019-39-0
Wiley ID 1818854