CID 14275505

2-propylcyclohexan-1-amine

Structural Information

Molecular Formula
C9H19N
SMILES
CCCC1CCCCC1N
InChI
InChI=1S/C9H19N/c1-2-5-8-6-3-4-7-9(8)10/h8-9H,2-7,10H2,1H3
InChIKey
DWVNXHKKIRXAOL-UHFFFAOYSA-N
Compound name
2-propylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

277
Patents

141.15175 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.159026 133.8
[M+Na]+ 164.140968 138.1
[M-H]- 140.144474 136.0
[M+NH4]+ 159.185573 154.9
[M+K]+ 180.114908 136.6
[M+H-H2O]+ 124.149010 128.2
[M+HCOO]- 186.149951 154.3
[M+CH3COO]- 200.165601 177.7
[M+Na-2H]- 162.126416 137.5
[M]+ 141.15120142 127.9
[M]- 141.15229858 127.9
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