CID 421053

52430-81-6

Structural Information

Molecular Formula
C9H19N
SMILES
CC(C)C1CCC(CC1)N
InChI
InChI=1S/C9H19N/c1-7(2)8-3-5-9(10)6-4-8/h7-9H,3-6,10H2,1-2H3
InChIKey
MFRKYEJMLQUSJX-UHFFFAOYSA-N
Compound name
4-propan-2-ylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

533
Patents

141.15175 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 133.5
[M+Na]+ 164.14097 143.2
[M+NH4]+ 159.18557 142.8
[M+K]+ 180.11491 137.3
[M-H]- 140.14447 136.3
[M+Na-2H]- 162.12642 138.2
[M]+ 141.15120 135.5
[M]- 141.15230 135.5
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