CID 544651

102653-37-2

Structural Information

Molecular Formula
C9H19N
SMILES
CCCC1CCC(CC1)N
InChI
InChI=1S/C9H19N/c1-2-3-8-4-6-9(10)7-5-8/h8-9H,2-7,10H2,1H3
InChIKey
OZUBMBIDHPBIDL-UHFFFAOYSA-N
Compound name
4-propylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

951
Patents

141.15175 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 133.1
[M+Na]+ 164.14097 143.1
[M+NH4]+ 159.18557 142.5
[M+K]+ 180.11491 136.4
[M-H]- 140.14447 136.2
[M+Na-2H]- 162.12642 138.2
[M]+ 141.15120 135.2
[M]- 141.15230 135.2
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