CID 77230415

170843-46-6

Structural Information

Molecular Formula
C11H19NO2
SMILES
CCOC(=O)C1(CCCNC1)CC=C
InChI
InChI=1S/C11H19NO2/c1-3-6-11(10(13)14-4-2)7-5-8-12-9-11/h3,12H,1,4-9H2,2H3
InChIKey
ACRAKZKJOKCEEE-UHFFFAOYSA-N
Compound name
ethyl 3-prop-2-enylpiperidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.148866 147.5
[M+Na]+ 220.130808 151.8
[M-H]- 196.134314 147.2
[M+NH4]+ 215.175413 166.4
[M+K]+ 236.104748 149.7
[M+H-H2O]+ 180.138850 141.7
[M+HCOO]- 242.139791 164.1
[M+CH3COO]- 256.155441 180.5
[M+Na-2H]- 218.116256 151.1
[M]+ 197.14104142 143.6
[M]- 197.14213858 143.6
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.