PHENYL ACETATE(122-79-2) 13C NMR
Molecular FormulaC8H8O2
Molecular Weight136.15
InChIInChI=1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3
InChIKey IPBVNPXQWQGGJP-UHFFFAOYSA-N
SmilesC(OC1=CC=CC=C1)(=O)C
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![](https://www.chemicalbook.com/Spectrum/122-79-2_MS.gif)
Mass
MS-NW-0018
phenyl acetate
C8H8O2 (Mass of molecular ion: 136)
Source Temperature: 200 °C
Sample Temperature: 65 °C
Reservoir, 75 eV
14.0 1.0
15.0 4.6
18.0 4.8
27.0 1.4
28.0 2.2
29.0 1.3
37.0 1.1
38.0 2.7
39.0 11.0
40.0 4.3
42.0 1.8
43.0 24.7
45.0 8.7
47.0 1.4
50.0 2.1
51.0 2.8
55.0 3.2
56.0 1.3
60.0 6.8
62.0 1.2
63.0 2.5
64.0 1.0
65.0 10.0
66.0 14.5
77.0 1.6
84.0 1.0
93.0 1.3
94.0 100.0
95.0 6.9
136.0 9.8
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![](https://www.chemicalbook.com/Spectrum/122-79-2_1HNMR.jpg)
1HNMR (400 MHz, DMSO) δ 12.35 (s, H), 7.29 (m, 5H),
3.59 (s, 2H);
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![](https://www.chemicalbook.com/Spectrum/122-79-2_13CNMR.gif)
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![](https://www.chemicalbook.com/Spectrum/122-79-2_13CNMR_2.jpg)
13CNMR (100MHz, DMSO) δ 173.19, 135.50, 129.85, 128.71,
127.05, 41.18.