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Back ChemicalBook Home>CAS DataBase List>31501-11-8More Spectrum> cis-3-Hexenyl hexanoate(31501-11-8) MS

cis-3-Hexenyl hexanoate(31501-11-8) MS

Molecular FormulaC12H22O2

Molecular Weight198.3

InChIInChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5,7H,3-4,6,8-11H2,1-2H3/b7-5-

InChIKey RGACQXBDYBCJCY-ALCCZGGFSA-N

SmilesC(OCC/C=C\CC)(=O)CCCCC





  •     Assign.     Shift(ppm)
    A *1 5.47 B *1 5.32 C 4.063 D 2.36 E 2.29 F 2.06 G 1.62 J 1.49 to 1.09 K 0.96 L 0.93
    Spectral Code: 1H NMR : 90 MHz in CDCl3







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