CID 165764102

En300-37347580

Structural Information

Molecular Formula
C14H17BN2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=NC=C(N3C=C2)C=O
InChI
InChI=1S/C14H17BN2O3/c1-13(2)14(3,4)20-15(19-13)10-5-6-17-11(9-18)8-16-12(17)7-10/h5-9H,1-4H3
InChIKey
OCQVGNNSZJUBPU-UHFFFAOYSA-N
Compound name
7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1332 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.14048 155.1
[M+Na]+ 295.12242 167.7
[M-H]- 271.12592 163.0
[M+NH4]+ 290.16702 175.5
[M+K]+ 311.09636 166.6
[M+H-H2O]+ 255.13046 149.5
[M+HCOO]- 317.13140 175.6
[M+CH3COO]- 331.14705 169.5
[M+Na-2H]- 293.10787 160.5
[M]+ 272.13265 161.8
[M]- 272.13375 161.8
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.