CID 3062340

Thiazolo(5,4-c)pyridine-5(4h)-carboximidamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-n-cyano-n'-methyl-

Structural Information

Molecular Formula
C10H14N8S
SMILES
CN=C(NC#N)N1CCC2=C(C1)SC(=N2)N=C(N)N
InChI
InChI=1S/C10H14N8S/c1-14-9(15-5-11)18-3-2-6-7(4-18)19-10(16-6)17-8(12)13/h2-4H2,1H3,(H,14,15)(H4,12,13,16,17)
InChIKey
CABLXOSRJXFZBX-UHFFFAOYSA-N
Compound name
N-cyano-2-(diaminomethylideneamino)-N'-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

278.1062 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.11348 164.3
[M+Na]+ 301.09542 170.9
[M-H]- 277.09892 166.5
[M+NH4]+ 296.14002 178.2
[M+K]+ 317.06936 168.5
[M+H-H2O]+ 261.10346 148.9
[M+HCOO]- 323.10440 179.2
[M+CH3COO]- 337.12005 220.8
[M+Na-2H]- 299.08087 165.8
[M]+ 278.10565 155.6
[M]- 278.10675 155.6
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

patents stripe