CID 9571915

Nsc670877

Structural Information

Molecular Formula
C7H9ClN6S
SMILES
C1CSC2=NC(=C(N21)/C=N/N=C(N)N)Cl
InChI
InChI=1S/C7H9ClN6S/c8-5-4(3-11-13-6(9)10)14-1-2-15-7(14)12-5/h3H,1-2H2,(H4,9,10,13)/b11-3+
InChIKey
FJHASOKORXRLTI-QDEBKDIKSA-N
Compound name
2-[(E)-(6-chloro-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.0298 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.03708 151.0
[M+Na]+ 267.01902 160.2
[M-H]- 243.02252 155.4
[M+NH4]+ 262.06362 171.6
[M+K]+ 282.99296 156.6
[M+H-H2O]+ 227.02706 144.0
[M+HCOO]- 289.02800 168.8
[M+CH3COO]- 303.04365 200.0
[M+Na-2H]- 265.00447 152.5
[M]+ 244.02925 151.9
[M]- 244.03035 151.9
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.