CID 136320989

1h,2h,3h-pyrazolo[1,5-a]imidazole-7-carbonitrile

Structural Information

Molecular Formula
C6H6N4
SMILES
C1CN2C(=C(C=N2)C#N)N1
InChI
InChI=1S/C6H6N4/c7-3-5-4-9-10-2-1-8-6(5)10/h4,8H,1-2H2
InChIKey
ZXWKIFZLRULDQS-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-imidazo[1,2-b]pyrazole-7-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.05925 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.06653 124.2
[M+Na]+ 157.04847 135.0
[M-H]- 133.05197 122.6
[M+NH4]+ 152.09307 143.2
[M+K]+ 173.02241 131.3
[M+H-H2O]+ 117.05651 109.6
[M+HCOO]- 179.05745 140.6
[M+CH3COO]- 193.07310 135.8
[M+Na-2H]- 155.03392 129.1
[M]+ 134.05870 116.9
[M]- 134.05980 116.9
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.