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MassMS-IW-1066 phenoxathiin C12H8OS (Mass of molecular ion: 200)
Source Temperature: 200 °C Sample Temperature: 150 °C Reservoir, 75 eV
28.0 1.1 51.0 1.0 63.0 1.7 64.0 1.1 69.0 3.0 70.0 1.3 77.0 1.1 85.0 2.6 85.5 2.1 86.0 1.2 87.0 1.5 95.0 1.0 100.0 6.1 102.0 1.3 126.0 1.0 127.0 4.7 128.0 2.3 139.0 6.5 140.0 1.3 145.0 1.2 146.0 1.1 155.0 1.9 156.0 1.2 168.0 33.1 169.0 5.1 170.0 2.4 171.0 23.7 172.0 11.1 173.0 2.3 199.0 4.2 200.0 100.0 201.0 14.1 202.0 5.5
400 MHz in CDCl3
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1H NMR 399.65 MHz C12 H8 O S 0.041 g : 0.5 ml CDCl3 phenoxathiin 
Assign. Shift(ppm)
A 7.10 B 7.07 C 6.99 D 6.98 ASSIGNED BY C-H COSY
Hz ppm Int.2847.41 7.125 221 2845.95 7.122 254 2842.16 7.112 74 2839.72 7.106 514 2838.62 7.103 432 2837.77 7.101 418 2831.54 7.086 606 2830.44 7.083 673 2829.59 7.081 587 2825.56 7.071 171 2823.12 7.064 771 2821.78 7.061 574 2796.75 6.998 889 2795.90 6.996 1000 2794.56 6.993 618 2789.67 6.981 634 2788.21 6.977 691 2786.62 6.973 487 2782.71 6.963 270 2781.49 6.960 208
in CDCl3
KBr disc
nujol mull
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