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Back ChemicalBook Home>CAS DataBase List>3564-95-2More Spectrum> CIS-P-MENTHANE-3,8-DIOL(3564-95-2) 1H NMR

CIS-P-MENTHANE-3,8-DIOL(3564-95-2) 1H NMR

Molecular FormulaC10H20O2

Molecular Weight172.27

InChIInChI=1/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3/t7-,8-,9+/s3

InChIKey LMXFTMYMHGYJEI-JEQONRIINA-N

SmilesC([C@@H]1CC[C@@H](C)C[C@@H]1O)(O)(C)C |&1:1,4,7,r|


  •        ppm   Int.  Assign.
    73.26 860 1 68.08 1000 2 48.50 933 3 42.65 858 4 34.98 868 5 28.97 837 6 * 28.85 820 7 * 25.65 961 8 22.21 729 9 20.37 803 10 ASSIGNED BY C-H COSY.
    Spectral Code: 13C NMR : in CDCl3


  •     Assign.     Shift(ppm)
    A 4.400 B 3.41 C 3.14 D 1.82 E 1.80 F 1.78 G 1.71 J 1.67 K *1 1.355 L *1 1.216 M 1.15 N 1.04 P 0.92 Q 0.872 ASSIGNED BY C-H AND H-H COSY
    Spectral Code: 1H NMR : 400 MHz in CDCl3

  • Spectral Code: IR : nujol mull

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