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Trihexanoin
SpectraBase Compound ID FpiZIiHKv5L
InChI InChI=1S/C21H38O6/c1-4-7-10-13-19(22)25-16-18(27-21(24)15-12-9-6-3)17-26-20(23)14-11-8-5-2/h18H,4-17H2,1-3H3
InChIKey MAYCICSNZYXLHB-UHFFFAOYSA-N
Mol Weight 386.5 g/mol
Molecular Formula C21H38O6
Exact Mass 386.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNgbn1SPNdP
Name Hexanoic acid, 1,2,3-propanetriyl ester
CAS Registry Number 621-70-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O6
InChI InChI=1S/C21H38O6/c1-4-7-10-13-19(22)25-16-18(27-21(24)15-12-9-6-3)17-26-20(23)14-11-8-5-2/h18H,4-17H2,1-3H3
InChIKey MAYCICSNZYXLHB-UHFFFAOYSA-N
Molecular Weight 386.529 g/mol
SMILES C(COC(CCCCC)=O)(COC(CCCCC)=O)OC(CCCCC)=O
SPLASH splash10-0007-9000000000-802ecba06222b33a73a3
Source of Spectrum EP-4686-0-0
Synonyms 2,3-Bis(hexanoyloxy)propyl hexanoate 2,3-Di(hexanoyloxy)propyl hexanoate Caproic triglyceride Glycerol tricaproate Glycerol trihexanoate Glyceryl tricaproate Hexanoic acid 2,3-bis(1-oxohexoxy)propyl ester Hexanoic acid 2,3-dicaproyloxypropyl ester Hexanoin, tri- Palmitic acid triglyceride Tricaproin Tricapronin Tricaproylglycerol Trihexanoin Trihexanoyl glycerol AI3-07948 BRN 1806732 EINECS 210-701-5 NSC 406885
Wiley ID 1362660