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(1R,7R)-1,7-Dimethylnonyl propanoate
SpectraBase Compound ID bYSIo5AdFP
InChI InChI=1S/C14H28O2/c1-5-12(3)10-8-7-9-11-13(4)16-14(15)6-2/h12-13H,5-11H2,1-4H3/t12-,13-/m1/s1
InChIKey DHRLLFVOVDPRNS-CHWSQXEVSA-N
Mol Weight 228.38 g/mol
Molecular Formula C14H28O2
Exact Mass 228.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20oXvsrjt1A
Name (1R,7R)-1,7-Dimethylnonyl propanoate
Alternate Name(s) (1R,7R)-1,7-dimethylnonyl propionate Propanoic acid[(2R,8R)-8-methyldecan-2-yl]ester Propionic acid[(1R,7R)-1,7-dimethylnonyl]ester [(2R,8R)-8-methyldecan-2-yl]propanoate Propanoic acid [(2R,8R)-8-methyldecan-2-yl] ester [(1R,7R)-1,7-dimethylnonyl] propanoate [(2R,8R)-8-methyldecan-2-yl] propanoate
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Formula C14H28O2
InChI InChI=1S/C14H28O2/c1-5-12(3)10-8-7-9-11-13(4)16-14(15)6-2/h12-13H,5-11H2,1-4H3/t12-,13-/m1/s1
InChIKey DHRLLFVOVDPRNS-CHWSQXEVSA-N
Molecular Weight 228.376 g/mol
SMILES C(=O)(O[C@@](CCCCC[C@@](CC)(C)[H])(C)[H])CC
SPLASH splash10-0a4l-9100000000-779be6ed690e13bbab2c
Source of Spectrum KD-13-789-30
Wiley ID 1635172