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Hexanoic acid, 2-ethyl-2-propyl-, methyl ester
SpectraBase Compound ID 3Or7sYru0cM
InChI InChI=1S/C12H24O2/c1-5-8-10-12(7-3,9-6-2)11(13)14-4/h5-10H2,1-4H3
InChIKey NWCUOOHXVQFGAS-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jnv5vHCVKnh
Name Hexanoic acid, 2-ethyl-2-propyl-, methyl ester
CAS Registry Number 54889-60-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-5-8-10-12(7-3,9-6-2)11(13)14-4/h5-10H2,1-4H3
InChIKey NWCUOOHXVQFGAS-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES C(C(CCCC)(CCC)CC)(OC)=O
SPLASH splash10-052f-9300000000-2a544f264ea3ef30c756
Source of Spectrum AD-0-3572-0
Synonyms Methyl 2-ethyl-2-propylhexanoate 2-Ethyl-2-propyl-hexanoic acid methyl ester 2-Ethyl-2-propylhexanoic acid methyl ester
Wiley ID 23491