CID 15706387

Lidepran hydrochloride

Structural Information

Molecular Formula
C14H19NO2
SMILES
CC(=O)O[C@@H]([C@H]1CCCCN1)C2=CC=CC=C2
InChI
InChI=1S/C14H19NO2/c1-11(16)17-14(12-7-3-2-4-8-12)13-9-5-6-10-15-13/h2-4,7-8,13-15H,5-6,9-10H2,1H3/t13-,14-/m1/s1
InChIKey
BKPLVPRTTWIDNL-ZIAGYGMSSA-N
Compound name
[(R)-phenyl-[(2R)-piperidin-2-yl]methyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

1536
Patents

233.14159 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.14887 155.2
[M+Na]+ 256.13081 157.9
[M-H]- 232.13431 157.6
[M+NH4]+ 251.17541 170.0
[M+K]+ 272.10475 155.1
[M+H-H2O]+ 216.13885 147.1
[M+HCOO]- 278.13979 171.0
[M+CH3COO]- 292.15544 187.4
[M+Na-2H]- 254.11626 157.4
[M]+ 233.14104 149.4
[M]- 233.14214 149.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe