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]+ 211.180496 152.0
[M+Na]+ 233.162438 152.9
[M-H]- 209.165944 153.9
[M+NH4]+ 228.207043 169.2
[M+K]+ 249.136378 150.1
[M+H-H2O]+ 193.170480 144.2
[M+HCOO]- 255.171421 168.2
[M+CH3COO]- 269.187071 184.1
[M+Na-2H]- 231.147886 152.3
[M]+ 210.17267142 141.8
[M]- 210.17376858 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