CID 4362805

Tert-butyl n-[2-(piperidin-3-yl)ethyl]carbamate

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC(C)(C)OC(=O)NCCC1CCCNC1
InChI
InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14-8-6-10-5-4-7-13-9-10/h10,13H,4-9H2,1-3H3,(H,14,15)
InChIKey
XQIKKZRRQGXGHF-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-piperidin-3-ylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

228.18378 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.19106 157.6
[M+Na]+ 251.17300 159.9
[M-H]- 227.17650 156.9
[M+NH4]+ 246.21760 173.2
[M+K]+ 267.14694 158.3
[M+H-H2O]+ 211.18104 150.9
[M+HCOO]- 273.18198 173.1
[M+CH3COO]- 287.19763 188.8
[M+Na-2H]- 249.15845 160.6
[M]+ 228.18323 153.0
[M]- 228.18433 153.0
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