CID 22029174

Tert-butyl 4-aminopiperazine-1-carboxylate

Structural Information

Molecular Formula
C9H19N3O2
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)N
InChI
InChI=1S/C9H19N3O2/c1-9(2,3)14-8(13)11-4-6-12(10)7-5-11/h4-7,10H2,1-3H3
InChIKey
QMZFIRHRGPLKEV-UHFFFAOYSA-N
Compound name
tert-butyl 4-aminopiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

368
Patents

201.14772 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.15500 148.7
[M+Na]+ 224.13694 153.8
[M-H]- 200.14044 148.5
[M+NH4]+ 219.18154 164.8
[M+K]+ 240.11088 153.3
[M+H-H2O]+ 184.14498 141.7
[M+HCOO]- 246.14592 164.8
[M+CH3COO]- 260.16157 185.6
[M+Na-2H]- 222.12239 152.1
[M]+ 201.14717 144.8
[M]- 201.14827 144.8
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