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1,4-Diethylhexyl 2-methylbenzoate
SpectraBase Compound ID DmHlIv67naT
InChI InChI=1S/C18H28O2/c1-5-15(6-2)12-13-16(7-3)20-18(19)17-11-9-8-10-14(17)4/h8-11,15-16H,5-7,12-13H2,1-4H3
InChIKey OSUUJFZAEHQSPG-UHFFFAOYSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1qSpxdxD7u
Name 1,4-Diethylhexyl 2-methylbenzoate
Alternate Name(s) o-Toluic acid, 6-ethyl-3-octyl ester 2-Methylbenzoic acid 6-ethyloctan-3-yl ester 6-Ethyloctan-3-yl 2-methylbenzoate
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Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-5-15(6-2)12-13-16(7-3)20-18(19)17-11-9-8-10-14(17)4/h8-11,15-16H,5-7,12-13H2,1-4H3
InChIKey OSUUJFZAEHQSPG-UHFFFAOYSA-N
Molecular Weight 276.420 g/mol
SMILES C(OC(c1c(cccc1)C)=O)(CC)CCC(CC)CC
SPLASH splash10-00ko-9500000000-770ea777d9df5f0ebfa7
Source of Spectrum NP-8-7079-0
Wiley ID 1107550