CID 139291458

2138031-86-2

Structural Information

Molecular Formula
C9H12N4
SMILES
CC1CCN2C(=NC(=C2C#N)N)C1
InChI
InChI=1S/C9H12N4/c1-6-2-3-13-7(5-10)9(11)12-8(13)4-6/h6H,2-4,11H2,1H3
InChIKey
IPEDRKFMTBTIMN-UHFFFAOYSA-N
Compound name
2-amino-7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.1062 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.11348 137.2
[M+Na]+ 199.09542 147.6
[M-H]- 175.09892 137.9
[M+NH4]+ 194.14002 155.1
[M+K]+ 215.06936 143.3
[M+H-H2O]+ 159.10346 123.4
[M+HCOO]- 221.10440 153.7
[M+CH3COO]- 235.12005 148.3
[M+Na-2H]- 197.08087 141.0
[M]+ 176.10565 129.2
[M]- 176.10675 129.2
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.