CID 84918

N-(2-methylpropyl)cyclohexanamine hydrochloride

Structural Information

Molecular Formula
C10H21N
SMILES
CC(C)CNC1CCCCC1
InChI
InChI=1S/C10H21N/c1-9(2)8-11-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChIKey
ARHUUPGCYHESJV-UHFFFAOYSA-N
Compound name
N-(2-methylpropyl)cyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

248
Patents

155.1674 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.17468 138.7
[M+Na]+ 178.15662 141.4
[M-H]- 154.16012 141.0
[M+NH4]+ 173.20122 159.1
[M+K]+ 194.13056 140.4
[M+H-H2O]+ 138.16466 132.7
[M+HCOO]- 200.16560 158.6
[M+CH3COO]- 214.18125 181.2
[M+Na-2H]- 176.14207 142.4
[M]+ 155.16685 133.2
[M]- 155.16795 133.2
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