CID 165915677

Rac-tert-butyl n-{[(2r,4s)-4-(propan-2-yl)piperidin-2-yl]methyl}carbamate

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC(C)[C@@H]1CCN[C@@H](C1)CNC(=O)OC(C)(C)C
InChI
InChI=1S/C14H28N2O2/c1-10(2)11-6-7-15-12(8-11)9-16-13(17)18-14(3,4)5/h10-12,15H,6-9H2,1-5H3,(H,16,17)/t11-,12+/m1/s1
InChIKey
KTDPYGFPNNSYEC-NEPJUHHUSA-N
Compound name
tert-butyl N-[[(2S,4R)-4-propan-2-ylpiperidin-2-yl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.2151 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.222376 166.0
[M+Na]+ 279.204318 168.3
[M-H]- 255.207824 165.5
[M+NH4]+ 274.248923 180.8
[M+K]+ 295.178258 166.7
[M+H-H2O]+ 239.212360 159.5
[M+HCOO]- 301.213301 179.9
[M+CH3COO]- 315.228951 196.9
[M+Na-2H]- 277.189766 166.2
[M]+ 256.21455142 161.9
[M]- 256.21564858 161.9
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.