CID 28294539

1-[(dimethylamino)methyl]cyclohexan-1-amine

Structural Information

Molecular Formula
C9H20N2
SMILES
CN(C)CC1(CCCCC1)N
InChI
InChI=1S/C9H20N2/c1-11(2)8-9(10)6-4-3-5-7-9/h3-8,10H2,1-2H3
InChIKey
HTNKDMPOGICBHG-UHFFFAOYSA-N
Compound name
1-[(dimethylamino)methyl]cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

156.16264 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.169916 137.0
[M+Na]+ 179.151858 140.7
[M-H]- 155.155364 140.6
[M+NH4]+ 174.196463 159.5
[M+K]+ 195.125798 140.7
[M+H-H2O]+ 139.159900 131.4
[M+HCOO]- 201.160841 159.1
[M+CH3COO]- 215.176491 184.5
[M+Na-2H]- 177.137306 142.0
[M]+ 156.16209142 131.6
[M]- 156.16318858 131.6
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

patents stripe