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]+ 166.13388 136.9
[M+Na]+ 188.11582 142.1
[M-H]- 164.11932 140.3
[M+NH4]+ 183.16042 149.5
[M+K]+ 204.08976 143.4
[M+H-H2O]+ 148.12386 123.9
[M+HCOO]- 210.12480 157.1
[M+CH3COO]- 224.14045 184.4
[M+Na-2H]- 186.10127 139.5
[M]+ 165.12605 142.3
[M]- 165.12715 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.