CID 2756457

2-amino-1-(4-isopropyl-piperazin-1-yl)-ethanone dihydrochloride

Structural Information

Molecular Formula
C9H19N3O
SMILES
CC(C)N1CCN(CC1)C(=O)CN
InChI
InChI=1S/C9H19N3O/c1-8(2)11-3-5-12(6-4-11)9(13)7-10/h8H,3-7,10H2,1-2H3
InChIKey
XDMDSQSMNHEMBA-UHFFFAOYSA-N
Compound name
2-amino-1-(4-propan-2-ylpiperazin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

185.15282 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.160096 145.6
[M+Na]+ 208.142038 149.9
[M-H]- 184.145544 145.1
[M+NH4]+ 203.186643 162.0
[M+K]+ 224.115978 148.9
[M+H-H2O]+ 168.150080 138.1
[M+HCOO]- 230.151021 162.0
[M+CH3COO]- 244.166671 185.3
[M+Na-2H]- 206.127486 146.9
[M]+ 185.15227142 140.2
[M]- 185.15336858 140.2
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