4,4'-Dinitrodiphenyl disulfide(100-32-3) 13C NMR
Product Name4,4'-Dinitrodiphenyl disulfide
CAS100-32-3
Molecular FormulaC12H8N2O4S2
Molecular Weight308.33
InChIInChI=1S/C12H8N2O4S2/c15-13(16)9-1-5-11(6-2-9)19-20-12-7-3-10(4-8-12)14(17)18/h1-8H
InChIKey KWGZRLZJBLEVFZ-UHFFFAOYSA-N
SmilesS(C1=CC=C([N+]([O-])=O)C=C1)SC1=CC=C([N+]([O-])=O)C=C1
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MassMS-NW-6298 bis(p-nitrophenyl) disulfide C12H8N2O4S2 (Mass of molecular ion: 308)
Source Temperature: 150 °C Sample Temperature: 130 °C Direct, 75 eV
18.0 1.8 28.0 1.5 30.0 58.3 32.0 3.9 37.0 1.0 38.0 3.8 39.0 5.5 45.0 11.6 50.0 10.2 51.0 4.5 52.0 1.3 57.0 2.2 58.0 10.0 61.0 1.3 62.0 4.4 63.0 19.4 64.0 27.6 65.0 3.5 66.0 2.5 69.0 34.4 70.0 6.8 71.0 2.7 74.0 4.0 75.0 4.6 76.0 6.5 77.0 1.2 79.0 1.0 81.0 2.6 82.0 18.3 83.0 1.5 84.0 1.4 92.0 1.2 93.0 2.0 95.0 4.3 96.0 14.1 97.0 2.4 98.0 2.6 106.0 1.0 107.0 3.3 108.0 45.7 109.0 6.6 110.0 2.6 115.0 1.1 122.0 1.0 124.0 12.6 125.0 3.9 126.0 1.2 127.0 1.0 128.0 13.5 130.0 2.5 138.0 22.8 139.0 11.1 140.0 11.8 141.0 1.2 142.0 1.0 151.0 1.3 152.0 4.3 154.0 6.7 155.0 5.8 156.0 1.1 158.0 1.2 160.0 7.8 162.0 1.9 169.0 1.5 170.0 1.3 171.0 10.5 172.0 3.7 173.0 1.0 182.0 1.3 183.0 7.5 184.0 16.0 185.0 2.8 186.0 3.0 192.0 7.8 194.0 2.2 199.0 1.4 200.0 3.9 203.0 2.6 204.0 2.5 214.0 1.3 215.0 2.2 216.0 3.3 224.0 1.1 230.0 1.4 232.0 2.6 246.0 8.4 247.0 1.3 256.0 14.2 257.0 1.1 258.0 5.3 262.0 2.9 276.0 31.3 277.0 4.9 278.0 5.8 292.0 1.3 308.0 100.0 309.0 15.7 310.0 11.3 311.0 1.6 340.0 1.5
in DMSO-d6
KBr disc
nujol mull
