CID 13319532

93560-60-2

Structural Information

Molecular Formula
C10H12BrNO2
SMILES
C1CCOC(C1)OC2=C(N=CC=C2)Br
InChI
InChI=1S/C10H12BrNO2/c11-10-8(4-3-6-12-10)14-9-5-1-2-7-13-9/h3-4,6,9H,1-2,5,7H2
InChIKey
NXVQJPQYTUJVQP-UHFFFAOYSA-N
Compound name
2-bromo-3-(oxan-2-yloxy)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.00513 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.01241 147.7
[M+Na]+ 279.99435 151.5
[M+NH4]+ 275.03895 152.8
[M+K]+ 295.96829 151.2
[M-H]- 255.99785 150.8
[M+Na-2H]- 277.97980 152.0
[M]+ 257.00458 147.9
[M]- 257.00568 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

No patent data available for this compound.