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-bromopyridin-2-yl)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]+ 242.01750 146.3
[M+Na]+ 263.99944 157.2
[M-H]- 240.00294 153.1
[M+NH4]+ 259.04404 169.1
[M+K]+ 279.97338 146.2
[M+H-H2O]+ 224.00748 146.7
[M+HCOO]- 286.00842 165.3
[M+CH3COO]- 300.02407 160.9
[M+Na-2H]- 261.98489 152.8
[M]+ 241.00967 161.8
[M]- 241.01077 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