CID 54758808

3-bromo-2-(cyclopentyloxy)pyridine

Structural Information

Molecular Formula
C10H12BrNO
SMILES
C1CCC(C1)OC2=C(C=CC=N2)Br
InChI
InChI=1S/C10H12BrNO/c11-9-6-3-7-12-10(9)13-8-4-1-2-5-8/h3,6-8H,1-2,4-5H2
InChIKey
QZRZUVKOBQJBDD-UHFFFAOYSA-N
Compound name
3-bromo-2-cyclopentyloxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.01022 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.01750 147.1
[M+Na]+ 263.99944 157.4
[M-H]- 240.00294 154.7
[M+NH4]+ 259.04404 168.5
[M+K]+ 279.97338 147.2
[M+H-H2O]+ 224.00748 146.5
[M+HCOO]- 286.00842 167.3
[M+CH3COO]- 300.02407 186.7
[M+Na-2H]- 261.98489 152.9
[M]+ 241.00967 163.8
[M]- 241.01077 163.8
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.