CID 68857055

Tert-butyl 4-(3-aminopropyl)-4-methylpiperidine-1-carboxylate

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC1(CCN(CC1)C(=O)OC(C)(C)C)CCCN
InChI
InChI=1S/C14H28N2O2/c1-13(2,3)18-12(17)16-10-7-14(4,8-11-16)6-5-9-15/h5-11,15H2,1-4H3
InChIKey
RORXMFNDHUAQSA-UHFFFAOYSA-N
Compound name
tert-butyl 4-(3-aminopropyl)-4-methylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

256.2151 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.222376 164.9
[M+Na]+ 279.204318 168.8
[M-H]- 255.207824 165.6
[M+NH4]+ 274.248923 182.3
[M+K]+ 295.178258 167.6
[M+H-H2O]+ 239.212360 159.1
[M+HCOO]- 301.213301 180.7
[M+CH3COO]- 315.228951 197.5
[M+Na-2H]- 277.189766 167.1
[M]+ 256.21455142 162.7
[M]- 256.21564858 162.7
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