CID 18705586

1-cyclohexylethane-1,2-diamine

Structural Information

Molecular Formula
C8H18N2
SMILES
C1CCC(CC1)C(CN)N
InChI
InChI=1S/C8H18N2/c9-6-8(10)7-4-2-1-3-5-7/h7-8H,1-6,9-10H2
InChIKey
ZGITYUSQHMGSRF-UHFFFAOYSA-N
Compound name
1-cyclohexylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

192
Patents

142.147 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.154276 133.8
[M+Na]+ 165.136218 136.5
[M-H]- 141.139724 135.3
[M+NH4]+ 160.180823 153.8
[M+K]+ 181.110158 135.3
[M+H-H2O]+ 125.144260 127.7
[M+HCOO]- 187.145201 154.0
[M+CH3COO]- 201.160851 178.7
[M+Na-2H]- 163.121666 136.7
[M]+ 142.14645142 124.8
[M]- 142.14754858 124.8
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