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Hexanoic acid, 1,1-dimethyl-2-propynyl ester
SpectraBase Compound ID Dsni2oO5RpS
InChI InChI=1S/C11H18O2/c1-5-7-8-9-10(12)13-11(3,4)6-2/h2H,5,7-9H2,1,3-4H3
InChIKey GQQYGEPMGRLVSE-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GCcHbBAtk
Name Hexanoic acid, 1,1-dimethyl-2-propynyl ester
CAS Registry Number 56438-74-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-5-7-8-9-10(12)13-11(3,4)6-2/h2H,5,7-9H2,1,3-4H3
InChIKey GQQYGEPMGRLVSE-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES C(#C)C(OC(=O)CCCCC)(C)C
SPLASH splash10-01ba-9000000000-7606f06f33a71af36fdb
Source of Spectrum C-97-3775-0
Synonyms 1,1-Dimethyl-2-propynyl hexanoate 1,1-Dimethylpropargyl hexanoate
Wiley ID 1178624