CID 14466728

52346-11-9

Structural Information

Molecular Formula
C13H23NO2
SMILES
CC(C)(C)OC(=O)C[C@@H]1CCNC[C@@H]1C=C
InChI
InChI=1S/C13H23NO2/c1-5-10-9-14-7-6-11(10)8-12(15)16-13(2,3)4/h5,10-11,14H,1,6-9H2,2-4H3/t10-,11-/m0/s1
InChIKey
ZEHOOORBLCQKOE-QWRGUYRKSA-N
Compound name
tert-butyl 2-[(3R,4S)-3-ethenylpiperidin-4-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

225.17288 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.18016 155.9
[M+Na]+ 248.16210 164.4
[M+NH4]+ 243.20670 162.1
[M+K]+ 264.13604 159.7
[M-H]- 224.16560 154.9
[M+Na-2H]- 246.14755 158.1
[M]+ 225.17233 156.5
[M]- 225.17343 156.5
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