Product Name4-Methylthiosemicarbazide
CAS6610-29-3
Molecular FormulaC2H7N3S
Molecular Weight105.16
InChIInChI=1S/C2H7N3S/c1-4-2(6)5-3/h3H2,1H3,(H2,4,5,6)
InChIKey PTVZQOAHCSKAAS-UHFFFAOYSA-N
SmilesN(C(NC)=S)N
Mass
MS-NW-4968 4-methyl(thiosemicarbazide) C2H7N3S (Mass of molecular ion: 105)
Source Temperature: 140 °C Sample Temperature: 100 °C Direct, 75 eV
15.0 10.2 16.0 1.1 17.0 3.5 18.0 3.7 27.0 1.2 28.0 12.0 29.0 3.3 30.0 14.1 31.0 7.7 32.0 100.0 33.0 1.0 42.0 9.8 43.0 3.1 45.0 3.9 46.0 1.2 47.0 7.2 48.0 1.0 55.0 4.2 56.0 1.3 57.0 6.2 59.0 4.9 60.0 6.4 62.0 1.9 72.0 1.5 73.0 1.8 74.0 38.9 75.0 3.8 76.0 2.1 105.0 64.3 106.0 3.1 107.0 3.2
400 MHz in DMSO-d6
1H NMR | 399.65 MHz |
C2 H7 N3 S | 0.041 g : 0.5 ml DMSO-d6 |
4-methyl(thiosemicarbazide) |
Assign. Shift(ppm) |
Hz ppm Int.
3416.87 8.550 243 3121.46 7.811 82 1764.53 4.416 580 1160.89 2.905 977 1156.25 2.894 1000 1149.90 2.878 52
in DMSO-d6
KBr disc
nujol mull
4-Methylthiosemicarbazide(6610-29-3) Raman Atlas of Related Products
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