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1-Methylheptyl cyclopentanecarboxylate
SpectraBase Compound ID ABHl5DBDHG0
InChI InChI=1S/C14H26O2/c1-3-4-5-6-9-12(2)16-14(15)13-10-7-8-11-13/h12-13H,3-11H2,1-2H3
InChIKey HRFRQWBFOPYRPT-UHFFFAOYSA-N
Mol Weight 226.36 g/mol
Molecular Formula C14H26O2
Exact Mass 226.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gVmPf5LqHf
Name 1-Methylheptyl cyclopentanecarboxylate
Alternate Name(s) Cyclopentanecarboxylic acid, 2-octyl ester cyclopentanecarboxylic acid octan-2-yl ester Octan-2-yl cyclopentanecarboxylate
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Formula C14H26O2
InChI InChI=1S/C14H26O2/c1-3-4-5-6-9-12(2)16-14(15)13-10-7-8-11-13/h12-13H,3-11H2,1-2H3
InChIKey HRFRQWBFOPYRPT-UHFFFAOYSA-N
Molecular Weight 226.360 g/mol
SMILES C(C(OC(=O)C1CCCC1)C)CCCCC
SPLASH splash10-014j-9200000000-8a4786f27131aa76af5c
Source of Spectrum NP-5-6999-0
Wiley ID 1105076