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Back ChemicalBook Home>CAS DataBase List>629-83-4More Spectrum> METHYL MELISSATE(629-83-4) IR1

METHYL MELISSATE(629-83-4) IR1

Product NameMETHYL MELISSATE

CAS629-83-4

Molecular FormulaC31H62O2

Molecular Weight466.82

InChIInChI=1S/C31H62O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31(32)33-2/h3-30H2,1-2H3

InChIKey BIRUBGLRQLAEFF-UHFFFAOYSA-N

SmilesC(OC)(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C31 H62 O2 0.026 g : 0.5 ml CDCl3
    methyl triacontanoate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.662 B 2.29 C 1.62 D 1.26 E 0.89

         Hz     ppm     Int.
    

        328.00   3.663    114
        112.44   1.256   1000
    

KBr disc



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