CID 90104918

[1,2]thiazolo[3,4-b]pyrazin-3-amine

Structural Information

Molecular Formula
C5H4N4S
SMILES
C1=NC2=C(SN=C2N=C1)N
InChI
InChI=1S/C5H4N4S/c6-4-3-5(9-10-4)8-2-1-7-3/h1-2H,6H2
InChIKey
KXLHFWQFCMNKNJ-UHFFFAOYSA-N
Compound name
[1,2]thiazolo[3,4-b]pyrazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

152.01567 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.02295 123.8
[M+Na]+ 175.00489 136.6
[M-H]- 151.00839 125.5
[M+NH4]+ 170.04949 144.6
[M+K]+ 190.97883 133.2
[M+H-H2O]+ 135.01293 117.3
[M+HCOO]- 197.01387 143.5
[M+CH3COO]- 211.02952 138.5
[M+Na-2H]- 172.99034 131.2
[M]+ 152.01512 126.1
[M]- 152.01622 126.1
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