CID 3064609

7h-thiazolo(3,2-a)pyrimidin-7-one, 5-(diethylamino)-

Structural Information

Molecular Formula
C10H13N3OS
SMILES
CCN(CC)C1=CC(=O)N=C2N1C=CS2
InChI
InChI=1S/C10H13N3OS/c1-3-12(4-2)9-7-8(14)11-10-13(9)5-6-15-10/h5-7H,3-4H2,1-2H3
InChIKey
JNMFADVDIFMSGX-UHFFFAOYSA-N
Compound name
5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.07793 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.08521 145.8
[M+Na]+ 246.06715 157.2
[M-H]- 222.07065 150.3
[M+NH4]+ 241.11175 166.0
[M+K]+ 262.04109 154.4
[M+H-H2O]+ 206.07519 138.8
[M+HCOO]- 268.07613 166.4
[M+CH3COO]- 282.09178 192.3
[M+Na-2H]- 244.05260 150.3
[M]+ 223.07738 152.6
[M]- 223.07848 152.6
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.