CID 10910832

180307-56-6

Structural Information

Molecular Formula
C12H21NO2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C=C
InChI
InChI=1S/C12H21NO2/c1-5-10-6-8-13(9-7-10)11(14)15-12(2,3)4/h5,10H,1,6-9H2,2-4H3
InChIKey
LKUCYFONIRHGSQ-UHFFFAOYSA-N
Compound name
tert-butyl 4-ethenylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

156
Patents

211.15723 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.16451 150.9
[M+Na]+ 234.14645 155.9
[M-H]- 210.14995 152.3
[M+NH4]+ 229.19105 168.6
[M+K]+ 250.12039 154.7
[M+H-H2O]+ 194.15449 144.9
[M+HCOO]- 256.15543 167.2
[M+CH3COO]- 270.17108 186.7
[M+Na-2H]- 232.13190 153.5
[M]+ 211.15668 148.7
[M]- 211.15778 148.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe