CID 137935403

5-(bromomethyl)spiro[3.5]nonane

Structural Information

Molecular Formula
C10H17Br
SMILES
C1CCC2(CCC2)C(C1)CBr
InChI
InChI=1S/C10H17Br/c11-8-9-4-1-2-5-10(9)6-3-7-10/h9H,1-8H2
InChIKey
ZTAAAJUOSVEDMB-UHFFFAOYSA-N
Compound name
9-(bromomethyl)spiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.05136 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.05864 141.4
[M+Na]+ 239.04058 139.6
[M+NH4]+ 234.08518 145.6
[M+K]+ 255.01452 138.7
[M-H]- 215.04408 141.0
[M+Na-2H]- 237.02603 143.4
[M]+ 216.05081 139.0
[M]- 216.05191 139.0
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.