CID 16787928

3-aminocyclohexane-1-carboxamide

Structural Information

Molecular Formula
C7H14N2O
SMILES
C1CC(CC(C1)N)C(=O)N
InChI
InChI=1S/C7H14N2O/c8-6-3-1-2-5(4-6)7(9)10/h5-6H,1-4,8H2,(H2,9,10)
InChIKey
FNMALDXUUZQFPN-UHFFFAOYSA-N
Compound name
3-aminocyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

142.11061 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.11789 131.0
[M+Na]+ 165.09983 135.4
[M-H]- 141.10333 133.0
[M+NH4]+ 160.14443 151.2
[M+K]+ 181.07377 134.2
[M+H-H2O]+ 125.10787 125.3
[M+HCOO]- 187.10881 152.0
[M+CH3COO]- 201.12446 178.0
[M+Na-2H]- 163.08528 133.7
[M]+ 142.11006 122.8
[M]- 142.11116 122.8
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