CID 13518325

6-amino-2h,3h-imidazo[2,1-b][1,3]thiazole-5-carbonitrile

Structural Information

Molecular Formula
C6H6N4S
SMILES
C1CSC2=NC(=C(N21)C#N)N
InChI
InChI=1S/C6H6N4S/c7-3-4-5(8)9-6-10(4)1-2-11-6/h1-2,8H2
InChIKey
MYUVFHRJIRMDBA-UHFFFAOYSA-N
Compound name
6-amino-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.03131 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.03859 135.3
[M+Na]+ 189.02053 147.8
[M-H]- 165.02403 137.4
[M+NH4]+ 184.06513 156.0
[M+K]+ 204.99447 144.6
[M+H-H2O]+ 149.02857 122.5
[M+HCOO]- 211.02951 150.1
[M+CH3COO]- 225.04516 147.7
[M+Na-2H]- 187.00598 136.9
[M]+ 166.03076 130.8
[M]- 166.03186 130.8
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