CID 22110115

941203-82-3

Structural Information

Molecular Formula
C10H14N4O3
SMILES
COC1=NC(=NC(=C1C=O)N2CCOCC2)N
InChI
InChI=1S/C10H14N4O3/c1-16-9-7(6-15)8(12-10(11)13-9)14-2-4-17-5-3-14/h6H,2-5H2,1H3,(H2,11,12,13)
InChIKey
ZWDVGBAIHWYPER-UHFFFAOYSA-N
Compound name
2-amino-4-methoxy-6-morpholin-4-ylpyrimidine-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

238.1066 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.11388 154.5
[M+Na]+ 261.09582 161.9
[M-H]- 237.09932 157.2
[M+NH4]+ 256.14042 166.1
[M+K]+ 277.06976 160.4
[M+H-H2O]+ 221.10386 144.7
[M+HCOO]- 283.10480 172.1
[M+CH3COO]- 297.12045 192.7
[M+Na-2H]- 259.08127 159.4
[M]+ 238.10605 153.0
[M]- 238.10715 153.0
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

patents stripe