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5-(2-ketocyclopentyl)valeric acid methyl ester
SpectraBase Compound ID 4TFQn9xXfay
InChI InChI=1S/C11H18O3/c1-14-11(13)8-3-2-5-9-6-4-7-10(9)12/h9H,2-8H2,1H3
InChIKey KTPCWCANDYYQQV-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UGYsj5BKyI
Name 5-(2-ketocyclopentyl)valeric acid methyl ester
Alternate Name(s) 5-(2-oxocyclopentyl)pentanoic acid methyl ester Methyl 5-(2-oxidanylidenecyclopentyl)pentanoate Methyl 5-(2-oxocyclopentyl)pentanoate
CAS Registry Number 13672-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-14-11(13)8-3-2-5-9-6-4-7-10(9)12/h9H,2-8H2,1H3
InChIKey KTPCWCANDYYQQV-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES C1(=O)C(CCC1)CCCCC(=O)OC
SPLASH splash10-001i-9200000000-d6eb0c4c4b6786505430
Source of Spectrum J-53-2294-18
Wiley ID 1195546