Product Name3-BENZOYLACRYLIC ACID
CAS583-06-2
Molecular FormulaC10H8O3
Molecular Weight176.17
InChIInChI=1S/C10H8O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-7H,(H,12,13)
InChIKey PLPDHGOODMBBGN-UHFFFAOYSA-N
SmilesC(O)(=O)C=CC(=O)C1=CC=CC=C1

Mass
MS-IW-3917 3-benzoylacrylic acid C10H8O3 (Mass of molecular ion: 176)
Source Temperature: 120 °C Sample Temperature: 100 °C Direct, 75 eV
18.0 1.6
27.0 3.1
39.0 1.2
45.0 2.1
50.0 5.7
51.0 17.5
52.0 1.4
53.0 2.5
74.0 2.3
75.0 1.7
76.0 2.4
77.0 51.2
78.0 4.4
81.0 1.5
99.0 4.0
102.0 1.3
103.0 3.3
105.0 100.0
106.0 8.2
130.0 5.8
131.0 7.7
132.0 3.6
147.0 3.6
148.0 3.3
159.0 1.6
176.0 37.9
177.0 4.3

in CDCl3

KBr disc

nujol mull

3-BENZOYLACRYLIC ACID(583-06-2) MS Atlas of Related Products
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