CID 2761048

Tert-butyl 4-((furan-2-ylmethyl)amino)piperidine-1-carboxylate

Structural Information

Molecular Formula
C15H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)NCC2=CC=CO2
InChI
InChI=1S/C15H24N2O3/c1-15(2,3)20-14(18)17-8-6-12(7-9-17)16-11-13-5-4-10-19-13/h4-5,10,12,16H,6-9,11H2,1-3H3
InChIKey
FMYHQCQBDNMUDS-UHFFFAOYSA-N
Compound name
tert-butyl 4-(furan-2-ylmethylamino)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

280.17868 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.185956 167.9
[M+Na]+ 303.167898 171.4
[M-H]- 279.171404 172.9
[M+NH4]+ 298.212503 182.4
[M+K]+ 319.141838 170.9
[M+H-H2O]+ 263.175940 160.3
[M+HCOO]- 325.176881 185.5
[M+CH3COO]- 339.192531 199.3
[M+Na-2H]- 301.153346 170.3
[M]+ 280.17813142 166.8
[M]- 280.17922858 166.8
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