CID 105438405

(1-cyclohexyl-1h-pyrazol-5-yl)methanamine

Structural Information

Molecular Formula
C10H17N3
SMILES
C1CCC(CC1)N2C(=CC=N2)CN
InChI
InChI=1S/C10H17N3/c11-8-10-6-7-12-13(10)9-4-2-1-3-5-9/h6-7,9H,1-5,8,11H2
InChIKey
ZBBZJZLBUDIJSM-UHFFFAOYSA-N
Compound name
(2-cyclohexylpyrazol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

179.14224 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.149516 140.7
[M+Na]+ 202.131458 146.0
[M-H]- 178.134964 143.5
[M+NH4]+ 197.176063 159.0
[M+K]+ 218.105398 143.3
[M+H-H2O]+ 162.139500 132.3
[M+HCOO]- 224.140441 160.7
[M+CH3COO]- 238.156091 181.6
[M+Na-2H]- 200.116906 144.0
[M]+ 179.14169142 134.6
[M]- 179.14278858 134.6
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