CID 59239095

1207370-28-2

Structural Information

Molecular Formula
C15H18BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)NC(=O)C=C3
InChI
InChI=1S/C15H18BNO3/c1-14(2)15(3,4)20-16(19-14)11-6-7-12-10(9-11)5-8-13(18)17-12/h5-9H,1-4H3,(H,17,18)
InChIKey
JZUNBRFCAFIQJB-UHFFFAOYSA-N
Compound name
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

271.13797 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.14525 158.2
[M+Na]+ 294.12719 172.3
[M+NH4]+ 289.17179 169.0
[M+K]+ 310.10113 164.5
[M-H]- 270.13069 163.9
[M+Na-2H]- 292.11264 166.0
[M]+ 271.13742 162.3
[M]- 271.13852 162.3
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