1-(3-Chlorophenyl)piperazine hydrochloride(65369-76-8) MS
Product Name1-(3-Chlorophenyl)piperazine hydrochloride
CAS65369-76-8
Molecular FormulaC10H14Cl2N2
Molecular Weight233.14
InChIInChI=1S/C10H13ClN2.ClH/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13;/h1-3,8,12H,4-7H2;1H
InChIKey MHXPYWFZULXYHT-UHFFFAOYSA-N
SmilesC1(=CC=CC(Cl)=C1)N1CCNCC1.Cl
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MassMS-NW-8031 1-(m-chlorophenyl)piperazine hydrochloride C10H13ClN2 HCl (Mass of molecular ion: 196)
Source Temperature: 200 °C Sample Temperature: 130 °C Direct, 75 eV
15.0 1.2 27.0 2.1 28.0 8.6 29.0 6.7 30.0 4.5 35.0 2.0 36.0 14.2 38.0 4.7 39.0 1.1 41.0 1.6 42.0 4.2 43.0 1.3 50.0 2.1 51.0 2.7 54.0 1.0 55.0 1.0 56.0 12.4 57.0 6.7 63.0 1.4 74.0 1.0 75.0 6.0 76.0 1.6 77.0 4.1 89.0 1.0 91.0 1.1 98.0 1.6 104.0 1.0 111.0 7.7 112.0 1.6 113.0 2.7 117.0 1.1 118.0 2.4 119.0 4.2 125.0 3.1 127.0 1.3 138.0 7.9 139.0 8.3 140.0 5.7 141.0 3.8 142.0 1.1 154.0 100.0 155.0 9.5 156.0 32.4 157.0 3.1 196.0 36.5 197.0 5.0 198.0 12.0 199.0 1.5
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C10 H13 Cl N2 0.039 g : 0.5 ml DMSO-d6 1-(m-chlorophenyl)piperazine hydrochloride 
Assign. Shift(ppm)
A 9.66 B 7.264 C 7.040 D 6.956 E 6.871 F 3.46 G 3.18
Hz ppm Int.3863.37 9.667 215 2911.68 7.286 324 2903.59 7.266 543 2895.36 7.245 405 2815.70 7.046 315 2813.57 7.041 541 2811.43 7.035 360 2784.88 6.969 271 2783.20 6.965 225 2782.44 6.963 223 2777.10 6.949 219 2776.49 6.948 227 2774.81 6.944 205 2751.31 6.885 278 2750.55 6.883 305 2749.33 6.880 289 2748.72 6.878 269 2743.38 6.865 261 2742.77 6.863 266 2741.55 6.860 272 1387.79 3.473 619 1381.68 3.458 1000 1377.41 3.447 708 1276.09 3.194 540 1271.36 3.182 646 1266.63 3.170 436
in DMSO-d6
KBr disc
nujol mull
