CID 13038189

4-(2-chlorothieno[2,3-d]pyrimidin-4-yl)morpholine

Structural Information

Molecular Formula
C10H10ClN3OS
SMILES
C1COCCN1C2=C3C=CSC3=NC(=N2)Cl
InChI
InChI=1S/C10H10ClN3OS/c11-10-12-8(14-2-4-15-5-3-14)7-1-6-16-9(7)13-10/h1,6H,2-5H2
InChIKey
YPVVQAPITTYKRL-UHFFFAOYSA-N
Compound name
4-(2-chlorothieno[2,3-d]pyrimidin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

84
Patents

255.02332 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.03060 150.5
[M+Na]+ 278.01254 161.7
[M-H]- 254.01604 155.2
[M+NH4]+ 273.05714 166.7
[M+K]+ 293.98648 157.7
[M+H-H2O]+ 238.02058 143.1
[M+HCOO]- 300.02152 160.0
[M+CH3COO]- 314.03717 162.9
[M+Na-2H]- 275.99799 154.2
[M]+ 255.02277 153.5
[M]- 255.02387 153.5
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