CID 18374734

Tert-butyl 4-(3-(methylamino)propyl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)CCCNC
InChI
InChI=1S/C14H28N2O2/c1-14(2,3)18-13(17)16-10-7-12(8-11-16)6-5-9-15-4/h12,15H,5-11H2,1-4H3
InChIKey
ICLCZARBACNRHZ-UHFFFAOYSA-N
Compound name
tert-butyl 4-[3-(methylamino)propyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

256.2151 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.222376 165.8
[M+Na]+ 279.204318 168.7
[M-H]- 255.207824 166.6
[M+NH4]+ 274.248923 181.3
[M+K]+ 295.178258 167.5
[M+H-H2O]+ 239.212360 158.8
[M+HCOO]- 301.213301 182.2
[M+CH3COO]- 315.228951 198.6
[M+Na-2H]- 277.189766 167.6
[M]+ 256.21455142 164.3
[M]- 256.21564858 164.3
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