CID 208278

Thiazolo(4,5-d)pyrimidine-5,7(4h,6h)-dione, 4,6-dimethyl-2-(2-propenylamino)-

Structural Information

Molecular Formula
C10H12N4O2S
SMILES
CN1C2=C(C(=O)N(C1=O)C)SC(=N2)NCC=C
InChI
InChI=1S/C10H12N4O2S/c1-4-5-11-9-12-7-6(17-9)8(15)14(3)10(16)13(7)2/h4H,1,5H2,2-3H3,(H,11,12)
InChIKey
BULKNJNLDAUORC-UHFFFAOYSA-N
Compound name
4,6-dimethyl-2-(prop-2-enylamino)-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.0681 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.07538 153.0
[M+Na]+ 275.05732 167.1
[M-H]- 251.06082 155.6
[M+NH4]+ 270.10192 170.5
[M+K]+ 291.03126 161.8
[M+H-H2O]+ 235.06536 146.3
[M+HCOO]- 297.06630 172.1
[M+CH3COO]- 311.08195 196.0
[M+Na-2H]- 273.04277 155.8
[M]+ 252.06755 160.1
[M]- 252.06865 160.1
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