1-Methylguanidine hydrochloride(21770-81-0) MS
Product Name1-Methylguanidine hydrochloride
CAS21770-81-0
Molecular FormulaC2H8ClN3
Molecular Weight109.56
InChIInChI=1S/C2H7N3.ClH/c1-5-2(3)4;/h1H3,(H4,3,4,5);1H
InChIKey VJQCNCOGZPSOQZ-UHFFFAOYSA-N
SmilesC(=N)(N)NC.Cl
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MassMS-NW-5516 1-methylguanidine hydrochloride C2H7N3 HCl (Mass of molecular ion: 73)
Source Temperature: 200 °C Sample Temperature: 120 °C Direct, 75 eV
13.0 1.7 14.0 1.6 15.0 7.2 16.0 2.0 17.0 3.5 18.0 5.0 26.0 1.0 27.0 6.4 28.0 41.1 29.0 5.5 30.0 81.4 31.0 21.7 32.0 1.0 35.0 14.0 36.0 59.7 37.0 4.7 38.0 19.3 41.0 4.1 42.0 18.8 43.0 100.0 44.0 25.0 45.0 4.2 53.0 2.5 55.0 13.2 56.0 13.5 57.0 25.6 58.0 1.1 72.0 22.2 73.0 85.8 74.0 3.4 129.0 1.6 135.0 1.0
parameter in D2O
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1H NMR 300 MHz C2 H7 N3 0.041 g : 0.5 ml D2O 1-methylguanidine hydrochloride 
Parameter ppm Hz
D(A) 2.835
Hz ppm Int.850.50 2.835 1000
in D2O
KBr disc
nujol mull
