CID 5325864

(1s)-2-bromocyclohex-2-en-1-ol

Structural Information

Molecular Formula
C6H9BrO
SMILES
C1CC=C([C@H](C1)O)Br
InChI
InChI=1S/C6H9BrO/c7-5-3-1-2-4-6(5)8/h3,6,8H,1-2,4H2/t6-/m0/s1
InChIKey
SVDKKDWANPIULS-LURJTMIESA-N
Compound name
(1S)-2-bromocyclohex-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

175.98367 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.99095 128.6
[M+Na]+ 198.97289 131.4
[M+NH4]+ 194.01749 134.4
[M+K]+ 214.94683 131.4
[M-H]- 174.97639 129.3
[M+Na-2H]- 196.95834 131.9
[M]+ 175.98312 127.9
[M]- 175.98422 127.9
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.