CID 18926474

N-(cyclohexylmethyl)pyrrolidine-2-carboxamide

Structural Information

Molecular Formula
C12H22N2O
SMILES
C1CCC(CC1)CNC(=O)C2CCCN2
InChI
InChI=1S/C12H22N2O/c15-12(11-7-4-8-13-11)14-9-10-5-2-1-3-6-10/h10-11,13H,1-9H2,(H,14,15)
InChIKey
LLYXKTBOYKNPTF-UHFFFAOYSA-N
Compound name
N-(cyclohexylmethyl)pyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

210.17322 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18050 152.0
[M+Na]+ 233.16244 152.9
[M-H]- 209.16594 153.9
[M+NH4]+ 228.20704 169.2
[M+K]+ 249.13638 150.1
[M+H-H2O]+ 193.17048 144.2
[M+HCOO]- 255.17142 168.2
[M+CH3COO]- 269.18707 184.1
[M+Na-2H]- 231.14789 152.3
[M]+ 210.17267 141.8
[M]- 210.17377 141.8
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