CID 22574154

148148-48-5

Structural Information

Molecular Formula
C16H22N2O4
SMILES
CN(C(=O)C1CCN(CC1)C(=O)OCC2=CC=CC=C2)OC
InChI
InChI=1S/C16H22N2O4/c1-17(21-2)15(19)14-8-10-18(11-9-14)16(20)22-12-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3
InChIKey
XVSOLNIURSFPEU-UHFFFAOYSA-N
Compound name
benzyl 4-[methoxy(methyl)carbamoyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

306.15796 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.16524 171.5
[M+Na]+ 329.14718 174.2
[M-H]- 305.15068 176.9
[M+NH4]+ 324.19178 184.5
[M+K]+ 345.12112 173.9
[M+H-H2O]+ 289.15522 162.2
[M+HCOO]- 351.15616 190.4
[M+CH3COO]- 365.17181 207.6
[M+Na-2H]- 327.13263 172.4
[M]+ 306.15741 171.3
[M]- 306.15851 171.3
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