CID 3056894

73855-56-8

Structural Information

Molecular Formula
C5H6N2OS2
SMILES
CN1C(=C(SC1=S)C=N)O
InChI
InChI=1S/C5H6N2OS2/c1-7-4(8)3(2-6)10-5(7)9/h2,6,8H,1H3
InChIKey
HRGOUHVSPRZYMS-UHFFFAOYSA-N
Compound name
4-hydroxy-5-methanimidoyl-3-methyl-1,3-thiazole-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.99216 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.99944 130.8
[M+Na]+ 196.98138 142.1
[M-H]- 172.98488 132.9
[M+NH4]+ 192.02598 151.9
[M+K]+ 212.95532 136.9
[M+H-H2O]+ 156.98942 125.8
[M+HCOO]- 218.99036 144.7
[M+CH3COO]- 233.00601 176.8
[M+Na-2H]- 194.96683 130.6
[M]+ 173.99161 132.0
[M]- 173.99271 132.0
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

No patent data available for this compound.