5-叔-丁基焦酚(20481-17-8)核磁图(13CNMR)
InChI:InChI=1S/C10H14O3/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,1-3H3
InChIKey: HCNISNCKPIVZDX-UHFFFAOYSA-N
Smiles:C1(O)=CC(C(C)(C)C)=CC(O)=C1O
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Mass
MS-NW-2008
5-tert-butylpyrogallol
C10H14O3 (Mass of molecular ion: 182)
Source Temperature: 170 °C
Sample Temperature: 120 °C
Direct, 75 eV
18.0 3.0
27.0 1.8
28.0 1.2
29.0 1.5
39.0 4.4
41.0 6.5
43.0 2.7
50.0 1.0
51.0 2.8
52.0 1.3
53.0 2.2
55.0 2.2
65.0 2.1
67.0 1.0
69.0 1.0
77.0 3.5
79.0 1.4
81.0 1.4
91.0 3.2
93.0 1.7
103.0 1.6
109.0 3.0
121.0 6.8
123.0 2.0
126.0 2.3
127.0 4.3
135.0 1.2
139.0 11.1
140.0 1.0
149.0 3.6
152.0 1.0
166.0 1.3
167.0 100.0
168.0 10.0
169.0 1.0
182.0 37.5
183.0 4.1