CID 723429

Tert-butyl (piperidin-4-ylmethyl)carbamate

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CC(C)(C)OC(=O)NCC1CCNCC1
InChI
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-8-9-4-6-12-7-5-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKey
VHYXAWLOJGIJPC-UHFFFAOYSA-N
Compound name
tert-butyl N-(piperidin-4-ylmethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1883
Patents

214.16812 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.175396 153.1
[M+Na]+ 237.157338 155.9
[M-H]- 213.160844 152.7
[M+NH4]+ 232.201943 169.3
[M+K]+ 253.131278 154.5
[M+H-H2O]+ 197.165380 146.6
[M+HCOO]- 259.166321 169.0
[M+CH3COO]- 273.181971 185.7
[M+Na-2H]- 235.142786 156.6
[M]+ 214.16757142 148.1
[M]- 214.16866858 148.1
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