CID 83667885

2060033-94-3

Structural Information

Molecular Formula
C6H8N4S
SMILES
CC1=NN(C2=C1SC(=N2)N)C
InChI
InChI=1S/C6H8N4S/c1-3-4-5(10(2)9-3)8-6(7)11-4/h1-2H3,(H2,7,8)
InChIKey
YMHIONBCJZUOKV-UHFFFAOYSA-N
Compound name
1,3-dimethylpyrazolo[3,4-d][1,3]thiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.04697 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.05425 131.5
[M+Na]+ 191.03619 145.4
[M-H]- 167.03969 134.0
[M+NH4]+ 186.08079 154.0
[M+K]+ 207.01013 142.6
[M+H-H2O]+ 151.04423 125.7
[M+HCOO]- 213.04517 151.5
[M+CH3COO]- 227.06082 146.6
[M+Na-2H]- 189.02164 134.0
[M]+ 168.04642 135.9
[M]- 168.04752 135.9
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.