CID 242471

2,3-dihydro-1h-imidazo[1,2-b]pyrazole

Structural Information

Molecular Formula
C5H7N3
SMILES
C1CN2C(=CC=N2)N1
InChI
InChI=1S/C5H7N3/c1-2-7-8-4-3-6-5(1)8/h1-2,6H,3-4H2
InChIKey
KPMVHELZNRNSMN-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-imidazo[1,2-b]pyrazole
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

44
References

2529
Patents

109.063995 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.07127 119.8
[M+Na]+ 132.05321 128.8
[M-H]- 108.05672 119.1
[M+NH4]+ 127.09782 142.4
[M+K]+ 148.02715 127.2
[M+H-H2O]+ 92.061255 112.7
[M+HCOO]- 154.06220 140.3
[M+CH3COO]- 168.07785 133.5
[M+Na-2H]- 130.03866 126.2
[M]+ 109.06345 117.0
[M]- 109.06454 117.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe