CID 93499

Pipoxazole

Structural Information

Molecular Formula
C14H20N4O
SMILES
C1CN(CCN1CC2CN=C(O2)N)C3=CC=CC=C3
InChI
InChI=1S/C14H20N4O/c15-14-16-10-13(19-14)11-17-6-8-18(9-7-17)12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H2,15,16)
InChIKey
XSZLHACSCSAKOF-UHFFFAOYSA-N
Compound name
5-[(4-phenylpiperazin-1-yl)methyl]-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

260.1637 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.17098 162.1
[M+Na]+ 283.15292 173.7
[M+NH4]+ 278.19752 169.5
[M+K]+ 299.12686 169.4
[M-H]- 259.15642 167.7
[M+Na-2H]- 281.13837 168.8
[M]+ 260.16315 165.1
[M]- 260.16425 165.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.