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Hexanoic acid, 2-ethyl-, decyl ester
SpectraBase Compound ID 5iXp8zC9rS
InChI InChI=1S/C18H36O2/c1-4-7-9-10-11-12-13-14-16-20-18(19)17(6-3)15-8-5-2/h17H,4-16H2,1-3H3
InChIKey NPTQTLMUAAVGNU-UHFFFAOYSA-N
Mol Weight 284.5 g/mol
Molecular Formula C18H36O2
Exact Mass 284.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0yHX1CmISG
Name Hexanoic acid, 2-ethyl-, decyl ester
Alternate Name(s) Decyl 2-ethylhexanoate 2-Ethylhexanoic acid decyl ester EINECS 298-078-6
CAS Registry Number 93777-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O2
InChI InChI=1S/C18H36O2/c1-4-7-9-10-11-12-13-14-16-20-18(19)17(6-3)15-8-5-2/h17H,4-16H2,1-3H3
InChIKey NPTQTLMUAAVGNU-UHFFFAOYSA-N
Molecular Weight 284.484 g/mol
SMILES C(CCCCCCCCC)OC(C(CC)CCCC)=O
SPLASH splash10-0002-4900000000-b420442d053fc74165c6
Source of Spectrum O-22-474-6
Wiley ID 1288343