产品名称:3,3-二甲基-2-丁醇
CAS:464-07-3
分子式:C6H14O
分子量: 102.17
InChI:InChI=1S/C6H14O/c1-5(7)6(2,3)4/h5,7H,1-4H3
InChIKey: DFOXKPDFWGNLJU-UHFFFAOYSA-N
Smiles:CC(O)C(C)(C)C
MS
1HNMR
13CNMR
IR1
IR2
Raman
Mass
MS-NW-1199 3,3-dimethyl-2-butanol C6H14O (Mass of molecular ion: 102)
Source Temperature: 250 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 2.7 18.0 1.6 19.0 1.9 27.0 10.4 28.0 2.9 29.0 24.8 31.0 1.6 39.0 10.0 40.0 1.7 41.0 58.4 42.0 3.2 43.0 9.1 44.0 4.1 45.0 83.4 46.0 1.9 47.0 1.0 53.0 2.1 55.0 4.6 56.0 54.5 57.0 100.0 58.0 4.5 59.0 1.4 69.0 27.7 70.0 1.7 71.0 1.9 84.0 1.3 87.0 25.9 88.0 1.4 102.0 1.7
90 MHz in CDCl3
Assign. Shift(ppm) A 3.465 B 1.63 C 1.117 D 0.892
Hz ppm Int.
313.75 3.504 33 307.38 3.433 34 145.69 1.627 63 103.13 1.152 205 96.69 1.080 188 81.69 0.913 24 79.88 0.892 1000 77.75 0.869 41
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
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3,3-二甲基-2-丁醇(464-07-3)Raman光谱相关产品图谱