Bifenox(42576-02-3) 13C NMR
Product NameBifenox
CAS42576-02-3
Molecular FormulaC14H9Cl2NO5
Molecular Weight342.13
InChIInChI=1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3
InChIKey SUSRORUBZHMPCO-UHFFFAOYSA-N
SmilesC(OC)(=O)C1=CC(OC2=CC=C(Cl)C=C2Cl)=CC=C1[N+]([O-])=O
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MassMS2001-00734WA bifenox C14H9Cl2NO5 (Mass of molecular ion: 341)
Source Temperature: 210 °C Sample Temperature: 25 °C Direct, 70 eV
15.0 1.5 30.0 2.9 39.0 1.0 50.0 1.8 51.0 2.1 53.0 1.2 59.0 2.7 62.0 3.3 63.0 9.9 64.0 1.5 69.0 1.2 73.0 1.8 74.0 8.1 75.0 20.8 76.0 7.4 77.0 1.6 79.0 4.9 87.0 1.0 91.0 1.0 92.0 1.3 97.0 1.1 98.0 1.0 104.0 3.2 107.0 1.1 109.0 4.5 110.0 1.4 111.0 1.8 123.0 1.0 126.0 1.6 133.0 5.2 135.0 2.4 137.0 3.5 138.0 3.7 139.0 4.7 140.0 1.3 145.0 6.1 147.0 4.3 148.0 1.0 149.0 1.8 155.0 3.8 156.0 2.5 161.0 3.6 162.0 1.9 163.0 2.2 172.0 1.1 173.0 21.1 174.0 4.8 175.0 8.2 176.0 2.1 183.0 2.2 185.0 1.5 189.0 12.5 190.0 1.8 191.0 6.1 196.0 1.4 200.0 2.6 201.0 2.2 202.0 12.3 203.0 4.9 204.0 4.6 205.0 2.1 207.0 1.8 209.0 4.8 211.0 2.7 216.0 1.0 217.0 2.9 218.0 1.8 219.0 1.1 223.0 1.5 225.0 1.2 229.0 1.1 231.0 1.8 236.0 9.1 237.0 2.7 238.0 6.2 239.0 1.8 240.0 1.3 252.0 1.0 255.0 2.0 257.0 1.1 266.0 1.5 274.0 1.1 280.0 2.6 281.0 6.0 282.0 2.6 283.0 4.5 285.0 1.2 295.0 2.7 297.0 1.7 310.0 19.0 311.0 12.9 312.0 14.1 313.0 8.5 314.0 3.2 315.0 1.4 325.0 1.0 341.0 100.0 342.0 15.5 343.0 65.8 344.0 10.2 345.0 11.3 346.0 1.7
in CDCl3
in CDCl3
KBr disk
Nujol
