香草醛縮丙酮(1080-12-2)質(zhì)譜(MS)
InChI:InChI=1S/C11H12O3/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2/h3-7,13H,1-2H3
InChIKey: AFWKBSMFXWNGRE-UHFFFAOYSA-N
Smiles:CC(=O)C=CC1=CC=C(O)C(OC)=C1
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Mass
MS2001-00876WA
4-(4-hydroxy-3-methoxyphenyl)-but-3-en-2-one
C11H12O3 (Mass of molecular ion: 192)
Source Temperature: 225 °C
Sample Temperature: 20 °C
Direct, 70 eV
39.0 2.4
43.0 8.5
50.0 1.8
51.0 5.1
52.0 2.7
53.0 1.9
55.0 1.7
62.0 1.3
63.0 3.8
65.0 2.0
67.0 1.2
77.0 6.6
78.0 5.8
79.0 1.3
89.0 11.6
90.0 1.4
91.0 3.6
103.0 2.7
105.0 4.3
106.0 3.7
117.0 19.2
118.0 3.7
119.0 1.2
121.0 1.4
131.0 1.9
133.0 1.9
134.0 9.6
135.0 1.3
145.0 52.2
146.0 6.1
147.0 1.6
148.0 1.3
149.0 14.3
150.0 1.5
161.0 6.9
162.0 1.8
175.0 8.0
176.0 2.6
177.0 95.2
178.0 10.1
179.0 1.1
191.0 23.9
192.0 100.0
193.0 12.2
194.0 1.3