CID 19178

N-propylcyclohexanamine hydrochloride

Structural Information

Molecular Formula
C9H19N
SMILES
CCCNC1CCCCC1
InChI
InChI=1S/C9H19N/c1-2-8-10-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3
InChIKey
PXKCSKRXWAZGFK-UHFFFAOYSA-N
Compound name
N-propylcyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1558
Patents

141.15175 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 133.6
[M+Na]+ 164.14097 143.6
[M+NH4]+ 159.18557 143.2
[M+K]+ 180.11491 136.4
[M-H]- 140.14447 136.8
[M+Na-2H]- 162.12642 139.4
[M]+ 141.15120 135.8
[M]- 141.15230 135.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe