CID 165940921

(2s,4s)-4-cyclohexyl-n-methylpyrrolidine-2-carboxamide hydrochloride

Structural Information

Molecular Formula
C12H22N2O
SMILES
CNC(=O)[C@@H]1C[C@H](CN1)C2CCCCC2
InChI
InChI=1S/C12H22N2O/c1-13-12(15)11-7-10(8-14-11)9-5-3-2-4-6-9/h9-11,14H,2-8H2,1H3,(H,13,15)/t10-,11+/m1/s1
InChIKey
WYCZVPVNSGMJRY-MNOVXSKESA-N
Compound name
(2S,4S)-4-cyclohexyl-N-methylpyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.17322 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18050 152.2
[M+Na]+ 233.16244 154.0
[M-H]- 209.16594 154.5
[M+NH4]+ 228.20704 169.7
[M+K]+ 249.13638 151.2
[M+H-H2O]+ 193.17048 144.7
[M+HCOO]- 255.17142 168.3
[M+CH3COO]- 269.18707 185.2
[M+Na-2H]- 231.14789 151.7
[M]+ 210.17267 142.4
[M]- 210.17377 142.4
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

No patent data available for this compound.