CID 28063967

1-cyclopentyl-4-methyl-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C9H15N3
SMILES
CC1=C(N(N=C1)C2CCCC2)N
InChI
InChI=1S/C9H15N3/c1-7-6-11-12(9(7)10)8-4-2-3-5-8/h6,8H,2-5,10H2,1H3
InChIKey
BFFFJOQCUYPKGU-UHFFFAOYSA-N
Compound name
1-cyclopentyl-4-methylpyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

165.1266 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 136.3
[M+Na]+ 188.115818 143.8
[M-H]- 164.119324 140.2
[M+NH4]+ 183.160423 157.3
[M+K]+ 204.089758 141.7
[M+H-H2O]+ 148.123860 128.7
[M+HCOO]- 210.124801 158.8
[M+CH3COO]- 224.140451 179.8
[M+Na-2H]- 186.101266 137.9
[M]+ 165.12605142 132.5
[M]- 165.12714858 132.5
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