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1-Cyclopentene-1-propanoic acid, 3-oxo-2-(2-pentynyl)-, methyl ester
SpectraBase Compound ID FZy5q1SGvrR
InChI InChI=1S/C14H18O3/c1-3-4-5-6-12-11(7-9-13(12)15)8-10-14(16)17-2/h3,6-10H2,1-2H3
InChIKey WQZLWRYKCWSHLB-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVoowaeRkfA
Name 1-Cyclopentene-1-propanoic acid, 3-oxo-2-(2-pentynyl)-, methyl ester
Alternate Name(s) Methyl 3-(3-oxo-2-pent-2-ynylcyclopent-1-enyl)propionate Methyl 3-[3-oxo-2-(2-pentynyl)-1-cyclopenten-1-yl]propanoate
CAS Registry Number 107052-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-4-5-6-12-11(7-9-13(12)15)8-10-14(16)17-2/h3,6-10H2,1-2H3
InChIKey WQZLWRYKCWSHLB-UHFFFAOYSA-N
Molecular Weight 234.295 g/mol
SMILES C1(=C(CCC1=O)CCC(=O)OC)CC#CCC
SPLASH splash10-03e9-0980000000-c8db03f3d90306de6950
Source of Spectrum KC-1988-1398-4
Wiley ID 1236143