CID 82467760

[1,2,4]triazolo[3,4-b][1,3]thiazol-3-amine

Structural Information

Molecular Formula
C4H4N4S
SMILES
C1=CSC2=NN=C(N21)N
InChI
InChI=1S/C4H4N4S/c5-3-6-7-4-8(3)1-2-9-4/h1-2H,(H2,5,6)
InChIKey
QRQGNFWDYUBNSW-UHFFFAOYSA-N
Compound name
[1,3]thiazolo[2,3-c][1,2,4]triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.01567 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.02295 121.6
[M+Na]+ 163.00489 134.7
[M-H]- 139.00839 123.7
[M+NH4]+ 158.04949 144.7
[M+K]+ 178.97883 132.6
[M+H-H2O]+ 123.01293 115.5
[M+HCOO]- 185.01387 142.4
[M+CH3COO]- 199.02952 136.9
[M+Na-2H]- 160.99034 126.6
[M]+ 140.01512 124.6
[M]- 140.01622 124.6
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

No patent data available for this compound.