CID 82380921

Tert-butyl 4-(pyrrolidin-3-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2CCNC2
InChI
InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-8-5-11(6-9-16)12-4-7-15-10-12/h11-12,15H,4-10H2,1-3H3
InChIKey
HPBKCERYOZOMSM-UHFFFAOYSA-N
Compound name
tert-butyl 4-pyrrolidin-3-ylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

254.19943 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.20671 163.6
[M+Na]+ 277.18865 170.7
[M+NH4]+ 272.23325 169.9
[M+K]+ 293.16259 168.3
[M-H]- 253.19215 163.5
[M+Na-2H]- 275.17410 165.7
[M]+ 254.19888 164.1
[M]- 254.19998 164.1
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

patents stripe