CID 72221063

5-bromo-2-cyclopropoxypyridine

Structural Information

Molecular Formula
C8H8BrNO
SMILES
C1CC1OC2=NC=C(C=C2)Br
InChI
InChI=1S/C8H8BrNO/c9-6-1-4-8(10-5-6)11-7-2-3-7/h1,4-5,7H,2-3H2
InChIKey
WFGHZOZHSRYNKT-UHFFFAOYSA-N
Compound name
5-bromo-2-cyclopropyloxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

65
Patents

212.97893 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.98621 130.4
[M+Na]+ 235.96815 136.4
[M+NH4]+ 231.01275 136.6
[M+K]+ 251.94209 137.2
[M-H]- 211.97165 138.0
[M+Na-2H]- 233.95360 138.5
[M]+ 212.97838 133.3
[M]- 212.97948 133.3
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