CID 83915217

2413899-24-6

Structural Information

Molecular Formula
C10H19NO2
SMILES
CC(C)(C)C1CCC(CN1)C(=O)O
InChI
InChI=1S/C10H19NO2/c1-10(2,3)8-5-4-7(6-11-8)9(12)13/h7-8,11H,4-6H2,1-3H3,(H,12,13)
InChIKey
PVJYUINQGVJHDK-UHFFFAOYSA-N
Compound name
6-tert-butylpiperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.14159 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 144.6
[M+Na]+ 208.13081 149.2
[M-H]- 184.13431 143.4
[M+NH4]+ 203.17541 161.8
[M+K]+ 224.10475 147.2
[M+H-H2O]+ 168.13885 139.4
[M+HCOO]- 230.13979 158.3
[M+CH3COO]- 244.15544 177.7
[M+Na-2H]- 206.11626 147.2
[M]+ 185.14104 138.8
[M]- 185.14214 138.8
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.