Product NameN-CYANO-N',S-DIMETHYLISOTHIOUREA
CAS5848-24-8
Molecular FormulaC4H7N3S
Molecular Weight129.18
InChIInChI=1S/C4H7N3S/c1-6-4(8-2)7-3-5/h1-2H3,(H,6,7)
InChIKey MHGGQXIPBPGZFB-UHFFFAOYSA-N
SmilesC(=NC)(SC)NC#N

Mass
MS-NW-9383 3-cyano-1,2-dimethylisothiourea C4H7N3S (Mass of molecular ion: 129)
Source Temperature: 140 °C Sample Temperature: 80 °C Direct, 75 eV
15.0 11.5
17.0 3.8
18.0 19.6
27.0 1.6
28.0 9.9
29.0 2.8
30.0 8.4
32.0 1.2
41.0 1.8
42.0 2.5
43.0 1.2
44.0 1.1
45.0 8.6
46.0 4.6
47.0 9.0
48.0 9.1
53.0 2.9
55.0 15.5
56.0 3.8
57.0 78.4
58.0 5.3
59.0 1.4
62.0 1.4
67.0 1.8
68.0 5.0
72.0 1.6
73.0 1.2
74.0 4.1
80.0 1.8
81.0 2.5
82.0 100.0
83.0 7.8
85.0 2.0
87.0 1.1
89.0 3.5
99.0 4.2
129.0 36.4
130.0 2.7
131.0 1.7

KBr disc

nujol mull

N-CYANO-N',S-DIMETHYLISOTHIOUREA(5848-24-8) IR1 Atlas of Related Products
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