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Hexanoic acid tert-butyl ester
SpectraBase Compound ID 6kZxFjjweRG
InChI InChI=1S/C10H20O2/c1-5-6-7-8-9(11)12-10(2,3)4/h5-8H2,1-4H3
InChIKey DANUJARGWMPVQX-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANKIVS2hJmP
Name Hexanoic acid tert-butyl ester
CAS Registry Number 2492-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-5-6-7-8-9(11)12-10(2,3)4/h5-8H2,1-4H3
InChIKey DANUJARGWMPVQX-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES C(OC(C)(C)C)(=O)CCCCC
SPLASH splash10-00kb-9500000000-f528e5a2e0905fc2151a
Source of Spectrum AT-39-9258-1
Synonyms Hexanoic acid, 1,1-dimethylethyl ester tert-Butyl hexanoate
Wiley ID 854354