CID 135435147

4(3h)-pyrimidinone, 2-amino-5-bromo-6-(4-hydroxyphenyl)-

Structural Information

Molecular Formula
C10H8BrN3O2
SMILES
C1=CC(=CC=C1C2=C(C(=O)NC(=N2)N)Br)O
InChI
InChI=1S/C10H8BrN3O2/c11-7-8(13-10(12)14-9(7)16)5-1-3-6(15)4-2-5/h1-4,15H,(H3,12,13,14,16)
InChIKey
BPQDHWHENINUML-UHFFFAOYSA-N
Compound name
2-amino-5-bromo-4-(4-hydroxyphenyl)-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

280.97998 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.98726 153.3
[M+Na]+ 303.96920 157.6
[M+NH4]+ 299.01380 156.4
[M+K]+ 319.94314 158.2
[M-H]- 279.97270 154.1
[M+Na-2H]- 301.95465 157.3
[M]+ 280.97943 152.8
[M]- 280.98053 152.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.