CID 55288616

1-cyclobutyl-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C7H11N3
SMILES
C1CC(C1)N2C(=CC=N2)N
InChI
InChI=1S/C7H11N3/c8-7-4-5-9-10(7)6-2-1-3-6/h4-6H,1-3,8H2
InChIKey
AQVBPLARFOVVQX-UHFFFAOYSA-N
Compound name
2-cyclobutylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

137.09529 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.102566 125.4
[M+Na]+ 160.084508 131.8
[M-H]- 136.088014 129.0
[M+NH4]+ 155.129113 139.2
[M+K]+ 176.058448 133.1
[M+H-H2O]+ 120.092550 112.8
[M+HCOO]- 182.093491 147.3
[M+CH3COO]- 196.109141 177.7
[M+Na-2H]- 158.069956 130.5
[M]+ 137.09474142 130.8
[M]- 137.09583858 130.8
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