CID 72219140

2222333-27-7

Structural Information

Molecular Formula
C14H20BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OC3CC3
InChI
InChI=1S/C14H20BNO3/c1-13(2)14(3,4)19-15(18-13)10-5-8-12(16-9-10)17-11-6-7-11/h5,8-9,11H,6-7H2,1-4H3
InChIKey
XAMGEBGDXSLIPI-UHFFFAOYSA-N
Compound name
2-cyclopropyloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

261.15363 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.16091 160.3
[M+Na]+ 284.14285 174.8
[M+NH4]+ 279.18745 171.7
[M+K]+ 300.11679 168.8
[M-H]- 260.14635 174.1
[M+Na-2H]- 282.12830 171.5
[M]+ 261.15308 167.9
[M]- 261.15418 167.9
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