CID 582451

5-hydrazinyl-3-methyl-1,2,4-thiadiazole dihydrochloride

Structural Information

Molecular Formula
C3H6N4S
SMILES
CC1=NSC(=N1)NN
InChI
InChI=1S/C3H6N4S/c1-2-5-3(6-4)8-7-2/h4H2,1H3,(H,5,6,7)
InChIKey
XTMSUZWMADSAPP-UHFFFAOYSA-N
Compound name
(3-methyl-1,2,4-thiadiazol-5-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

130.03131 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.038586 121.0
[M+Na]+ 153.020528 130.7
[M-H]- 129.024034 122.5
[M+NH4]+ 148.065133 142.2
[M+K]+ 168.994468 128.8
[M+H-H2O]+ 113.028570 114.3
[M+HCOO]- 175.029511 141.7
[M+CH3COO]- 189.045161 172.7
[M+Na-2H]- 151.005976 125.5
[M]+ 130.03076142 120.6
[M]- 130.03185858 120.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe