CID 82412621

2-(4,4-dimethylcyclohexyl)propan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H23N
SMILES
CC(CN)C1CCC(CC1)(C)C
InChI
InChI=1S/C11H23N/c1-9(8-12)10-4-6-11(2,3)7-5-10/h9-10H,4-8,12H2,1-3H3
InChIKey
LGGOOBQUCGGFGG-UHFFFAOYSA-N
Compound name
2-(4,4-dimethylcyclohexyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.18304 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.19032 142.5
[M+Na]+ 192.17226 146.7
[M-H]- 168.17576 144.8
[M+NH4]+ 187.21686 164.5
[M+K]+ 208.14620 145.4
[M+H-H2O]+ 152.18030 137.6
[M+HCOO]- 214.18124 161.3
[M+CH3COO]- 228.19689 184.2
[M+Na-2H]- 190.15771 145.0
[M]+ 169.18249 137.0
[M]- 169.18359 137.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.