CID 7010304

Tert-butyl piperidine-1-carboxylate

Structural Information

Molecular Formula
C10H19NO2
SMILES
CC(C)(C)OC(=O)N1CCCCC1
InChI
InChI=1S/C10H19NO2/c1-10(2,3)13-9(12)11-7-5-4-6-8-11/h4-8H2,1-3H3
InChIKey
RQCNHUCCQJMSRG-UHFFFAOYSA-N
Compound name
tert-butyl piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

10003
Patents

185.14159 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 144.0
[M+Na]+ 208.13081 148.6
[M-H]- 184.13431 145.4
[M+NH4]+ 203.17541 162.5
[M+K]+ 224.10475 148.5
[M+H-H2O]+ 168.13885 138.0
[M+HCOO]- 230.13979 160.8
[M+CH3COO]- 244.15544 180.4
[M+Na-2H]- 206.11626 148.3
[M]+ 185.14104 141.4
[M]- 185.14214 141.4
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