CID 12636417

2230800-14-1

Structural Information

Molecular Formula
C8H15BrO
SMILES
CC(C)O[C@@H]1CCC[C@H]1Br
InChI
InChI=1S/C8H15BrO/c1-6(2)10-8-5-3-4-7(8)9/h6-8H,3-5H2,1-2H3/t7-,8-/m1/s1
InChIKey
LHKYTKOMTZFCMT-HTQZYQBOSA-N
Compound name
(1R,2R)-1-bromo-2-propan-2-yloxycyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.03062 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.03790 143.1
[M+Na]+ 229.01984 143.8
[M+NH4]+ 224.06444 148.4
[M+K]+ 244.99378 145.5
[M-H]- 205.02334 143.0
[M+Na-2H]- 227.00529 143.9
[M]+ 206.03007 141.8
[M]- 206.03117 141.8
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.