CID 82380942

Tert-butyl 3-(pyrrolidin-2-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)C2CCCN2
InChI
InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-9-5-6-11(10-16)12-7-4-8-15-12/h11-12,15H,4-10H2,1-3H3
InChIKey
UNWNLPIFWJPVTN-UHFFFAOYSA-N
Compound name
tert-butyl 3-pyrrolidin-2-ylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.19943 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.206706 165.4
[M+Na]+ 277.188648 167.8
[M-H]- 253.192154 166.4
[M+NH4]+ 272.233253 180.4
[M+K]+ 293.162588 165.6
[M+H-H2O]+ 237.196690 157.7
[M+HCOO]- 299.197631 177.2
[M+CH3COO]- 313.213281 190.1
[M+Na-2H]- 275.174096 164.3
[M]+ 254.19888142 158.4
[M]- 254.19997858 158.4
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.