CID 81205920

[4-(6-aminoquinazolin-4-yl)morpholin-2-yl]methanol

Structural Information

Molecular Formula
C13H16N4O2
SMILES
C1COC(CN1C2=NC=NC3=C2C=C(C=C3)N)CO
InChI
InChI=1S/C13H16N4O2/c14-9-1-2-12-11(5-9)13(16-8-15-12)17-3-4-19-10(6-17)7-18/h1-2,5,8,10,18H,3-4,6-7,14H2
InChIKey
BLCHUJURUIXFSB-UHFFFAOYSA-N
Compound name
[4-(6-aminoquinazolin-4-yl)morpholin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.12732 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.13460 160.9
[M+Na]+ 283.11654 168.0
[M-H]- 259.12004 162.9
[M+NH4]+ 278.16114 171.9
[M+K]+ 299.09048 164.1
[M+H-H2O]+ 243.12458 150.9
[M+HCOO]- 305.12552 175.4
[M+CH3COO]- 319.14117 170.6
[M+Na-2H]- 281.10199 167.0
[M]+ 260.12677 156.8
[M]- 260.12787 156.8
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.