CID 54593698

1-(aminomethyl)cyclopentane-1-carboxamide

Structural Information

Molecular Formula
C7H14N2O
SMILES
C1CCC(C1)(CN)C(=O)N
InChI
InChI=1S/C7H14N2O/c8-5-7(6(9)10)3-1-2-4-7/h1-5,8H2,(H2,9,10)
InChIKey
DWVJVUQKCKNIHY-UHFFFAOYSA-N
Compound name
1-(aminomethyl)cyclopentane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

142.11061 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.11789 130.8
[M+Na]+ 165.09983 136.0
[M-H]- 141.10333 133.1
[M+NH4]+ 160.14443 154.5
[M+K]+ 181.07377 135.0
[M+H-H2O]+ 125.10787 125.9
[M+HCOO]- 187.10881 153.9
[M+CH3COO]- 201.12446 176.1
[M+Na-2H]- 163.08528 134.3
[M]+ 142.11006 124.5
[M]- 142.11116 124.5
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