CID 69060998

1-(5-bromopyridin-2-yl)cyclopentan-1-ol

Structural Information

Molecular Formula
C10H12BrNO
SMILES
C1CCC(C1)(C2=NC=C(C=C2)Br)O
InChI
InChI=1S/C10H12BrNO/c11-8-3-4-9(12-7-8)10(13)5-1-2-6-10/h3-4,7,13H,1-2,5-6H2
InChIKey
UYGZZMAEKZGBDO-UHFFFAOYSA-N
Compound name
1-(5-bromo-2-pyridinyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

241.01022 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.017496 146.3
[M+Na]+ 263.999438 157.2
[M-H]- 240.002944 153.1
[M+NH4]+ 259.044043 169.1
[M+K]+ 279.973378 146.2
[M+H-H2O]+ 224.007480 146.7
[M+HCOO]- 286.008421 165.3
[M+CH3COO]- 300.024071 160.9
[M+Na-2H]- 261.984886 152.8
[M]+ 241.00967142 161.8
[M]- 241.01076858 161.8
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

patents stripe