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1,3-Cyclopentadiene-1-hexanoic acid, 1,1-dimethylethyl ester
SpectraBase Compound ID 5qg3TYAYPa2
InChI InChI=1S/C15H24O2/c1-15(2,3)17-14(16)12-6-4-5-9-13-10-7-8-11-13/h7-8,10H,4-6,9,11-12H2,1-3H3
InChIKey IPOFMXXCGAJKJD-UHFFFAOYSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpaRMsPkfKU
Name 1,3-Cyclopentadiene-1-hexanoic acid, 1,1-dimethylethyl ester
CAS Registry Number 105039-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-15(2,3)17-14(16)12-6-4-5-9-13-10-7-8-11-13/h7-8,10H,4-6,9,11-12H2,1-3H3
InChIKey IPOFMXXCGAJKJD-UHFFFAOYSA-N
Molecular Weight 236.355 g/mol
SMILES C(OC(C)(C)C)(=O)CCCCCC1=CC=CC1
SPLASH splash10-0a4i-9100000000-b73ad589a26ee7f13d7e
Source of Spectrum C-108-7954-4
Synonyms 1,1-Dimethylethyl-1,3-cyclopentadiene-1-hexanoate tert-Butyl 6-(1,3-cyclopentadien-1-yl)hexanoate
Wiley ID 1238684