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tert-Pentyl hexanoate
SpectraBase Compound ID FRf9H4Q55Z5
InChI InChI=1S/C11H22O2/c1-5-7-8-9-10(12)13-11(3,4)6-2/h5-9H2,1-4H3
InChIKey AHCUHYGSYJHBFT-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4p1f4HYr7w
Name tert-Pentyl hexanoate
Alternate Name(s) 1,1-Dimethylpropyl hexanoate 2-Methylbutan-2-yl hexanoate Hexanoic acid 2-methylbutan-2-yl ester Hexanoic acid tert-amyl ester Hexanoic acid, 1,1-dimethylpropyl ester
CAS Registry Number 116423-69-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-5-7-8-9-10(12)13-11(3,4)6-2/h5-9H2,1-4H3
InChIKey AHCUHYGSYJHBFT-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES CC(OC(CCCCC)=O)(CC)C
SPLASH splash10-00dl-9000000000-d5db9ea666275ebb2ca5
Wiley ID 1494678