CID 70900617

Tert-butyl n-{2-[(piperidin-4-yl)formamido]ethyl}carbamate hydrochloride

Structural Information

Molecular Formula
C13H25N3O3
SMILES
CC(C)(C)OC(=O)NCCNC(=O)C1CCNCC1
InChI
InChI=1S/C13H25N3O3/c1-13(2,3)19-12(18)16-9-8-15-11(17)10-4-6-14-7-5-10/h10,14H,4-9H2,1-3H3,(H,15,17)(H,16,18)
InChIKey
OKJGIKLPRXPNQO-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(piperidine-4-carbonylamino)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

271.1896 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.19688 166.4
[M+Na]+ 294.17882 167.4
[M-H]- 270.18232 165.6
[M+NH4]+ 289.22342 179.7
[M+K]+ 310.15276 166.2
[M+H-H2O]+ 254.18686 159.1
[M+HCOO]- 316.18780 182.1
[M+CH3COO]- 330.20345 198.5
[M+Na-2H]- 292.16427 168.4
[M]+ 271.18905 161.4
[M]- 271.19015 161.4
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.