CID 66489591

2479428-77-6

Structural Information

Molecular Formula
C6H9N3
SMILES
C1CC2=C(C1N)C=NN2
InChI
InChI=1S/C6H9N3/c7-5-1-2-6-4(5)3-8-9-6/h3,5H,1-2,7H2,(H,8,9)
InChIKey
DQHZMXHDEXKPFB-UHFFFAOYSA-N
Compound name
1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

123.07965 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.086926 123.2
[M+Na]+ 146.068868 131.7
[M-H]- 122.072374 123.6
[M+NH4]+ 141.113473 146.2
[M+K]+ 162.042808 129.3
[M+H-H2O]+ 106.076910 116.8
[M+HCOO]- 168.077851 145.0
[M+CH3COO]- 182.093501 136.8
[M+Na-2H]- 144.054316 128.2
[M]+ 123.07910142 118.8
[M]- 123.08019858 118.8
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