CID 13379295

Brn 4512287

Structural Information

Molecular Formula
C10H13N3O3S
SMILES
CCCOC(=O)NC1=CN=C2N(C1=O)CCS2
InChI
InChI=1S/C10H13N3O3S/c1-2-4-16-10(15)12-7-6-11-9-13(8(7)14)3-5-17-9/h6H,2-5H2,1H3,(H,12,15)
InChIKey
MJFLBNXLPLSRDG-UHFFFAOYSA-N
Compound name
propyl N-(5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.06776 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.07504 153.7
[M+Na]+ 278.05698 162.4
[M-H]- 254.06048 155.9
[M+NH4]+ 273.10158 171.4
[M+K]+ 294.03092 159.7
[M+H-H2O]+ 238.06502 146.8
[M+HCOO]- 300.06596 170.5
[M+CH3COO]- 314.08161 192.5
[M+Na-2H]- 276.04243 156.3
[M]+ 255.06721 157.8
[M]- 255.06831 157.8
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.