3-Amino-4-pyrazolecarbonitrile(16617-46-2) IR1
Product Name3-Amino-4-pyrazolecarbonitrile
CAS16617-46-2
Molecular FormulaC4H4N4
Molecular Weight108.1
InChIInChI=1S/C4H4N4/c5-1-3-2-7-8-4(3)6/h2H,(H3,6,7,8)
InChIKey FFNKBQRKZRMYCL-UHFFFAOYSA-N
SmilesN1C=C(C#N)C(N)=N1
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MassMS-IW-0651 3-amino-4-pyrazolecarbonitrile C4H4N4 (Mass of molecular ion: 108)
Source Temperature: 180 °C Sample Temperature: 140 °C Direct, 75 eV
18.0 3.4 27.0 1.1 28.0 13.8 29.0 3.6 38.0 2.7 39.0 3.1 40.0 1.6 42.0 1.2 43.0 9.5 51.0 2.9 52.0 11.1 53.0 14.5 54.0 12.4 57.0 1.2 64.0 1.2 65.0 1.4 66.0 3.0 67.0 1.8 77.0 2.1 78.0 1.1 79.0 7.1 80.0 1.0 81.0 4.6 108.0 100.0 109.0 7.1 184.0 1.0
KBr disc
nujol mull
