CID 12348194

3-bromocyclopentanol

Structural Information

Molecular Formula
C5H9BrO
SMILES
C1CC(CC1O)Br
InChI
InChI=1S/C5H9BrO/c6-4-1-2-5(7)3-4/h4-5,7H,1-3H2
InChIKey
NYSPEDOPWWKUSB-UHFFFAOYSA-N
Compound name
3-bromocyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

163.98367 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.99095 131.8
[M+Na]+ 186.97289 132.8
[M+NH4]+ 182.01749 137.2
[M+K]+ 202.94683 134.7
[M-H]- 162.97639 131.5
[M+Na-2H]- 184.95834 133.1
[M]+ 163.98312 130.5
[M]- 163.98422 130.5
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