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1-Ethylundecyl 3-cyclopentylpropanoate
SpectraBase Compound ID 5ua25M8mTgG
InChI InChI=1S/C21H40O2/c1-3-5-6-7-8-9-10-11-16-20(4-2)23-21(22)18-17-19-14-12-13-15-19/h19-20H,3-18H2,1-2H3
InChIKey LKDBSARHPJGNKH-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E98XOM3INx
Name 1-Ethylundecyl 3-cyclopentylpropanoate
Alternate Name(s) 3-Cyclopentylpropionic acid, 3-tridecyl ester 3-cyclopentylpropanoic acid tridecan-3-yl ester Tridecan-3-yl 3-cyclopentylpropanoate
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Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-3-5-6-7-8-9-10-11-16-20(4-2)23-21(22)18-17-19-14-12-13-15-19/h19-20H,3-18H2,1-2H3
InChIKey LKDBSARHPJGNKH-UHFFFAOYSA-N
Molecular Weight 324.549 g/mol
SMILES C1CCC(C1)CCC(OC(CC)CCCCCCCCCC)=O
SPLASH splash10-0a6u-9400000000-326058fe7e4a998f67c2
Source of Spectrum NP-11-4482-0
Wiley ID 1109617