CID 642851

Diethyl(3-pyridyl)borane

Structural Information

Molecular Formula
C9H14BN
SMILES
B(CC)(CC)C1=CN=CC=C1
InChI
InChI=1S/C9H14BN/c1-3-10(4-2)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3
InChIKey
OJKBCQOJVMAHDX-UHFFFAOYSA-N
Compound name
diethyl(pyridin-3-yl)borane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1381
Patents

147.12193 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.12921 132.0
[M+Na]+ 170.11115 145.3
[M+NH4]+ 165.15575 141.3
[M+K]+ 186.08509 138.1
[M-H]- 146.11465 134.4
[M+Na-2H]- 168.09660 139.9
[M]+ 147.12138 134.6
[M]- 147.12248 134.6
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

patents stripe