CID 73553355

1823731-18-5

Structural Information

Molecular Formula

C₆H₄Cl₂N₂O

SMILES

C1COC2=C1C(=NC(=N2)Cl)Cl

InChI

InChI=1S/C6H4Cl2N2O/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H2

InChIKey

TWUSNFOMZCUMDN-UHFFFAOYSA-N

Compound name

2,4-dichloro-5,6-dihydrofuro[2,3-d]pyrimidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 189.97006 Da
Monoisotopic Mass: 2.5
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]+	190.97734	133.3
[M+Na]+	212.95928	145.1
[M-H]-	188.96278	135.2
[M+NH4]+	208.00388	153.2
[M+K]+	228.93322	141.7
[M+H-H2O]+	172.96732	127.5
[M+HCOO]-	234.96826	144.5
[M+CH3COO]-	248.98391	147.0
[M+Na-2H]-	210.94473	140.2
[M]+	189.96951	136.5
[M]-	189.97061	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe