CID 210526

21271-25-0

Structural Information

Molecular Formula
C20H22N4O2
SMILES
C1CCN(CC1)CCOC2=C(C(=O)N3C=CN=CC3=N2)C4=CC=CC=C4
InChI
InChI=1S/C20H22N4O2/c25-20-18(16-7-3-1-4-8-16)19(22-17-15-21-9-12-24(17)20)26-14-13-23-10-5-2-6-11-23/h1,3-4,7-9,12,15H,2,5-6,10-11,13-14H2
InChIKey
AUERMYWBEPRZGQ-UHFFFAOYSA-N
Compound name
3-phenyl-2-(2-piperidin-1-ylethoxy)pyrazino[1,2-a]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1743 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.18158 185.6
[M+Na]+ 373.16352 201.7
[M+NH4]+ 368.20812 192.7
[M+K]+ 389.13746 192.7
[M-H]- 349.16702 190.5
[M+Na-2H]- 371.14897 194.8
[M]+ 350.17375 189.3
[M]- 350.17485 189.3
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

No patent data available for this compound.