CID 45358645

Tert-butyl n-[3-(piperidin-3-yl)phenyl]carbamate

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC(C)(C)OC(=O)NC1=CC=CC(=C1)C2CCCNC2
InChI
InChI=1S/C16H24N2O2/c1-16(2,3)20-15(19)18-14-8-4-6-12(10-14)13-7-5-9-17-11-13/h4,6,8,10,13,17H,5,7,9,11H2,1-3H3,(H,18,19)
InChIKey
MRRCMEJMLODJCD-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-piperidin-3-ylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.18378 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.19106 167.6
[M+Na]+ 299.17300 170.4
[M-H]- 275.17650 170.4
[M+NH4]+ 294.21760 181.0
[M+K]+ 315.14694 167.2
[M+H-H2O]+ 259.18104 159.6
[M+HCOO]- 321.18198 183.3
[M+CH3COO]- 335.19763 197.7
[M+Na-2H]- 297.15845 170.6
[M]+ 276.18323 162.3
[M]- 276.18433 162.3
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

No patent data available for this compound.