CID 43115677

3-(cyclohexylmethyl)-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C10H17N3
SMILES
C1CCC(CC1)CC2=CC(=NN2)N
InChI
InChI=1S/C10H17N3/c11-10-7-9(12-13-10)6-8-4-2-1-3-5-8/h7-8H,1-6H2,(H3,11,12,13)
InChIKey
XNVIUFYBFOAEOH-UHFFFAOYSA-N
Compound name
5-(cyclohexylmethyl)-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

179.14224 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.14952 141.1
[M+Na]+ 202.13146 146.0
[M-H]- 178.13496 142.5
[M+NH4]+ 197.17606 158.7
[M+K]+ 218.10540 142.3
[M+H-H2O]+ 162.13950 132.9
[M+HCOO]- 224.14044 159.6
[M+CH3COO]- 238.15609 152.0
[M+Na-2H]- 200.11691 143.9
[M]+ 179.14169 133.1
[M]- 179.14279 133.1
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