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

32
Patents

280.17868 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.18596 167.9
[M+Na]+ 303.16790 171.4
[M-H]- 279.17140 172.9
[M+NH4]+ 298.21250 182.4
[M+K]+ 319.14184 170.9
[M+H-H2O]+ 263.17594 160.3
[M+HCOO]- 325.17688 185.5
[M+CH3COO]- 339.19253 199.3
[M+Na-2H]- 301.15335 170.3
[M]+ 280.17813 166.8
[M]- 280.17923 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