CID 13379283

Brn 4529769

Structural Information

Molecular Formula

C₁₁H₁₀N₄O₃S

SMILES

CC1=CC(=NO1)NC(=O)C2=CN=C3N(C2=O)CCS3

InChI

InChI=1S/C11H10N4O3S/c1-6-4-8(14-18-6)13-9(16)7-5-12-11-15(10(7)17)2-3-19-11/h4-5H,2-3H2,1H3,(H,13,14,16)

InChIKey

UXMYPWGHEWHLLC-UHFFFAOYSA-N

Compound name

N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 278.04736 Da
Monoisotopic Mass: 0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	279.054636	159.0
[M+Na]+	301.036578	169.9
[M-H]-	277.040084	165.0
[M+NH4]+	296.081183	175.0
[M+K]+	317.010518	167.7
[M+H-H2O]+	261.044620	152.3
[M+HCOO]-	323.045561	175.9
[M+CH3COO]-	337.061211	171.6
[M+Na-2H]-	299.022026	160.3
[M]+	278.04681142	163.6
[M]-	278.04790858	163.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.