CID 43124235

Cyclobutyl(1-methyl-1h-pyrazol-4-yl)methanamine

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C=C(C=N1)C(C2CCC2)N
InChI
InChI=1S/C9H15N3/c1-12-6-8(5-11-12)9(10)7-3-2-4-7/h5-7,9H,2-4,10H2,1H3
InChIKey
OWYCPUFNFNEFKJ-UHFFFAOYSA-N
Compound name
cyclobutyl-(1-methylpyrazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 136.9
[M+Na]+ 188.115818 142.1
[M-H]- 164.119324 140.3
[M+NH4]+ 183.160423 149.5
[M+K]+ 204.089758 143.4
[M+H-H2O]+ 148.123860 123.9
[M+HCOO]- 210.124801 157.1
[M+CH3COO]- 224.140451 184.4
[M+Na-2H]- 186.101266 139.5
[M]+ 165.12605142 142.3
[M]- 165.12714858 142.3
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.