CID 68600823

Benzyl 4-[(2-methoxyethyl)amino]piperidine-1-carboxylate

Structural Information

Molecular Formula
C16H24N2O3
SMILES
COCCNC1CCN(CC1)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C16H24N2O3/c1-20-12-9-17-15-7-10-18(11-8-15)16(19)21-13-14-5-3-2-4-6-14/h2-6,15,17H,7-13H2,1H3
InChIKey
MRSBPLMYLLOCIF-UHFFFAOYSA-N
Compound name
benzyl 4-(2-methoxyethylamino)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

292.17868 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.185956 169.9
[M+Na]+ 315.167898 172.4
[M-H]- 291.171404 173.6
[M+NH4]+ 310.212503 183.0
[M+K]+ 331.141838 170.1
[M+H-H2O]+ 275.175940 160.5
[M+HCOO]- 337.176881 188.8
[M+CH3COO]- 351.192531 202.6
[M+Na-2H]- 313.153346 172.5
[M]+ 292.17813142 168.3
[M]- 292.17922858 168.3
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