CID 504338

4-(6,7-diphenylpteridin-4-yl)morpholine

Structural Information

Molecular Formula
C22H19N5O
SMILES
C1COCCN1C2=NC=NC3=C2N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C22H19N5O/c1-3-7-16(8-4-1)18-19(17-9-5-2-6-10-17)26-21-20(25-18)22(24-15-23-21)27-11-13-28-14-12-27/h1-10,15H,11-14H2
InChIKey
MWEVYUIKURMCEZ-UHFFFAOYSA-N
Compound name
4-(6,7-diphenylpteridin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.15897 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.16625 192.6
[M+Na]+ 392.14819 199.1
[M-H]- 368.15169 198.4
[M+NH4]+ 387.19279 195.6
[M+K]+ 408.12213 191.5
[M+H-H2O]+ 352.15623 176.8
[M+HCOO]- 414.15717 203.6
[M+CH3COO]- 428.17282 199.3
[M+Na-2H]- 390.13364 198.4
[M]+ 369.15842 188.0
[M]- 369.15952 188.0
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.