CID 122243104

Tert-butyl 4-cyclobutylidenepiperidine-1-carboxylate

Structural Information

Molecular Formula
C14H23NO2
SMILES
CC(C)(C)OC(=O)N1CCC(=C2CCC2)CC1
InChI
InChI=1S/C14H23NO2/c1-14(2,3)17-13(16)15-9-7-12(8-10-15)11-5-4-6-11/h4-10H2,1-3H3
InChIKey
KLNGOUPOOOOUGE-UHFFFAOYSA-N
Compound name
tert-butyl 4-cyclobutylidenepiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.17288 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.18016 156.0
[M+Na]+ 260.16210 158.4
[M-H]- 236.16560 159.8
[M+NH4]+ 255.20670 165.8
[M+K]+ 276.13604 159.9
[M+H-H2O]+ 220.17014 144.1
[M+HCOO]- 282.17108 169.9
[M+CH3COO]- 296.18673 193.4
[M+Na-2H]- 258.14755 157.2
[M]+ 237.17233 160.2
[M]- 237.17343 160.2
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

No patent data available for this compound.