CID 65462456

1-[1-(cyclobutylmethyl)-1h-pyrazol-4-yl]ethan-1-amine

Structural Information

Molecular Formula
C10H17N3
SMILES
CC(C1=CN(N=C1)CC2CCC2)N
InChI
InChI=1S/C10H17N3/c1-8(11)10-5-12-13(7-10)6-9-3-2-4-9/h5,7-9H,2-4,6,11H2,1H3
InChIKey
WXQHYPFVKUYFEG-UHFFFAOYSA-N
Compound name
1-[1-(cyclobutylmethyl)pyrazol-4-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.14224 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.14952 141.5
[M+Na]+ 202.13146 146.3
[M-H]- 178.13496 144.7
[M+NH4]+ 197.17606 153.5
[M+K]+ 218.10540 147.3
[M+H-H2O]+ 162.13950 128.3
[M+HCOO]- 224.14044 161.4
[M+CH3COO]- 238.15609 187.3
[M+Na-2H]- 200.11691 143.6
[M]+ 179.14169 147.2
[M]- 179.14279 147.2
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.