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Dodecyl-methyl-16-crown-4
SpectraBase Compound ID JOz9gF4UDha
InChI InChI=1S/C25H50O4/c1-3-4-5-6-7-8-9-10-11-12-16-25(2)23-28-21-14-19-26-17-13-18-27-20-15-22-29-24-25/h3-24H2,1-2H3
InChIKey PUAGIRCQBJBXHM-UHFFFAOYSA-N
Mol Weight 414.7 g/mol
Molecular Formula C25H50O4
Exact Mass 414.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhyZhX1B24G
Name Dodecyl-methyl-16-crown-4
Alternate Name(s) 3-Dodecyl-3-methyl-1,5,9,13-tetraoxacyclohexadecane
CAS Registry Number 92144-71-3
Comments Less than 3 mono-isotopic peaks
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Formula C25H50O4
InChI InChI=1S/C25H50O4/c1-3-4-5-6-7-8-9-10-11-12-16-25(2)23-28-21-14-19-26-17-13-18-27-20-15-22-29-24-25/h3-24H2,1-2H3
InChIKey PUAGIRCQBJBXHM-UHFFFAOYSA-N
Molecular Weight 414.671 g/mol
SMILES C1(COCCCOCCCOCCCOC1)(CCCCCCCCCCCC)C
SPLASH splash10-0udi-0900000000-046d833791b0bceb36af
Source of Spectrum C-106-6982-0
Wiley ID 1375587