CID 18002393

1-(1,3-oxazol-2-yl)piperazinedihydrochloride

Structural Information

Molecular Formula
C7H11N3O
SMILES
C1CN(CCN1)C2=NC=CO2
InChI
InChI=1S/C7H11N3O/c1-4-10(5-2-8-1)7-9-3-6-11-7/h3,6,8H,1-2,4-5H2
InChIKey
BKXLCMMXOWRLLA-UHFFFAOYSA-N
Compound name
2-piperazin-1-yl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

153.09021 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 132.5
[M+Na]+ 176.07943 143.8
[M+NH4]+ 171.12403 140.2
[M+K]+ 192.05337 140.4
[M-H]- 152.08293 135.0
[M+Na-2H]- 174.06488 138.4
[M]+ 153.08966 134.5
[M]- 153.09076 134.5
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