CID 11745988

548762-66-9

Structural Information

Molecular Formula
C11H22N2O2
SMILES
C[C@H]1CN[C@@H](CN1C(=O)OC(C)(C)C)C
InChI
InChI=1S/C11H22N2O2/c1-8-7-13(9(2)6-12-8)10(14)15-11(3,4)5/h8-9,12H,6-7H2,1-5H3/t8-,9+/m1/s1
InChIKey
PGZCVLUQTJRRAA-BDAKNGLRSA-N
Compound name
tert-butyl (2S,5R)-2,5-dimethylpiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

948
Patents

214.16812 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.17540 152.4
[M+Na]+ 237.15734 161.4
[M+NH4]+ 232.20194 158.3
[M+K]+ 253.13128 157.6
[M-H]- 213.16084 150.9
[M+Na-2H]- 235.14279 154.4
[M]+ 214.16757 152.9
[M]- 214.16867 152.9
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