GERANYL BROMIDE(6138-90-5) 1H NMR
Product NameGERANYL BROMIDE
CAS6138-90-5
Molecular FormulaC10H17Br
Molecular Weight217.15
InChIInChI=1S/C10H17Br/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6,8H2,1-3H3/b10-7+
InChIKey JSCUZAYKVZXKQE-JXMROGBWSA-N
SmilesC(Br)/C=C(\C)/CC/C=C(/C)\C
400 MHz in CDCl3
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1H NMR 399.65 MHz C10 H17 Br 0.05 ml : 0.5 ml CDCl3 (E)-1-bromo-3,7-dimethyl-2,6-octadiene 
Assign. Shift(ppm)
A 5.528 B 5.070 C 4.017 D 2.07 E 1.724 F 1.680 G 1.600 ASSIGNED BY H-H COSY.
Hz ppm Int.2218.51 5.552 79 2217.16 5.548 78 2211.30 5.534 91 2210.08 5.531 148 2208.74 5.527 152 2207.52 5.524 92 2201.54 5.509 76 2200.32 5.506 78 2031.86 5.085 66 2029.30 5.078 74 2027.83 5.075 109 2026.49 5.071 129 2025.02 5.067 105 2023.68 5.064 65 1609.74 4.028 527 1601.32 4.007 513 843.02 2.110 119 842.29 2.108 122 836.43 2.093 215 829.35 2.076 390 825.07 2.065 184 690.06 1.727 998 688.60 1.724 1000 672.24 1.683 791 671.26 1.680 804 639.16 1.600 871
in CDCl3
