CID 19602955

198627-75-7

Structural Information

Molecular Formula
C16H31N3O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)CCN2CCNCC2
InChI
InChI=1S/C16H31N3O2/c1-16(2,3)21-15(20)19-10-5-14(6-11-19)4-9-18-12-7-17-8-13-18/h14,17H,4-13H2,1-3H3
InChIKey
OLXGQEDRTXGTEH-UHFFFAOYSA-N
Compound name
tert-butyl 4-(2-piperazin-1-ylethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

297.24164 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.24892 178.7
[M+Na]+ 320.23086 179.2
[M-H]- 296.23436 177.4
[M+NH4]+ 315.27546 188.5
[M+K]+ 336.20480 176.3
[M+H-H2O]+ 280.23890 169.1
[M+HCOO]- 342.23984 186.1
[M+CH3COO]- 356.25549 199.5
[M+Na-2H]- 318.21631 178.1
[M]+ 297.24109 170.7
[M]- 297.24219 170.7
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