CID 81223577

8-bromo-5-oxaspiro[3.5]nonane

Structural Information

Molecular Formula
C8H13BrO
SMILES
C1CC2(C1)CC(CCO2)Br
InChI
InChI=1S/C8H13BrO/c9-7-2-5-10-8(6-7)3-1-4-8/h7H,1-6H2
InChIKey
FTEWGHWHMRMMML-UHFFFAOYSA-N
Compound name
8-bromo-5-oxaspiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.01498 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.02226 135.1
[M+Na]+ 227.00420 133.6
[M+NH4]+ 222.04880 139.1
[M+K]+ 242.97814 133.9
[M-H]- 203.00770 135.4
[M+Na-2H]- 224.98965 136.9
[M]+ 204.01443 133.0
[M]- 204.01553 133.0
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.