3,5-DIMETHYLPYRAZOLE-1-CARBOXAMIDINE NITRATE(38184-47-3) Raman
Product Name3,5-DIMETHYLPYRAZOLE-1-CARBOXAMIDINE NITRATE
CAS38184-47-3
Molecular FormulaC6H11N5O3
Molecular Weight201.18
InChIInChI=1S/C6H10N4.HNO3/c1-4-3-5(2)10(9-4)6(7)8;2-1(3)4/h3H,1-2H3,(H3,7,8);(H,2,3,4)
InChIKey AGYXIUAGBLMBGV-UHFFFAOYSA-N
SmilesN1(C(C)=CC(C)=N1)C(=N)N.[N+]([O-])(=O)O
-
MassMS-IW-0571 3,5-dimethyl-1-pyrazolecarboxamidine nitrate C6H10N4 HNO3 (Mass of molecular ion: 138)
Source Temperature: 200 °C Sample Temperature: 120 °C Direct, 75 eV
18.0 3.4 27.0 2.5 28.0 5.7 29.0 1.1 30.0 4.1 39.0 5.2 40.0 2.0 41.0 7.8 42.0 18.6 43.0 9.7 46.0 11.4 52.0 1.3 53.0 1.2 54.0 8.9 55.0 4.9 56.0 1.5 65.0 2.4 66.0 1.4 67.0 2.2 68.0 3.0 69.0 2.4 81.0 9.4 95.0 72.7 96.0 100.0 97.0 7.3 138.0 35.4 139.0 4.0
400 MHz in DMSO-d6
-
1H NMR 399.65 MHz C6 H10 N4 0.039 g : 0.5 ml DMSO-d6 3,5-dimethyl-1-pyrazolecarboxamidine nitrate 
Assign. Shift(ppm)
A 9.17 B 6.344 C *1 2.489 D *1 2.222
Hz ppm Int.3663.64 9.168 151 2535.25 6.344 222 995.18 2.491 698 994.42 2.489 727 888.37 2.223 1000
in DMSO-d6
KBr disc
nujol mull
4880 A,200 M,powder
