CID 44755196

1073354-84-3

Structural Information

Molecular Formula
C10H15BN2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CNC(=O)N=C2
InChI
InChI=1S/C10H15BN2O3/c1-9(2)10(3,4)16-11(15-9)7-5-12-8(14)13-6-7/h5-6H,1-4H3,(H,12,13,14)
InChIKey
JRCSRFGCQSLWNZ-UHFFFAOYSA-N
Compound name
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

222.11757 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.12485 144.8
[M+Na]+ 245.10679 157.3
[M+NH4]+ 240.15139 154.2
[M+K]+ 261.08073 151.5
[M-H]- 221.11029 148.5
[M+Na-2H]- 243.09224 152.3
[M]+ 222.11702 147.9
[M]- 222.11812 147.9
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