CID 137951484

1-(bromomethyl)-7,7-dimethylbicyclo[2.2.1]heptane

Structural Information

Molecular Formula
C10H17Br
SMILES
CC1(C2CCC1(CC2)CBr)C
InChI
InChI=1S/C10H17Br/c1-9(2)8-3-5-10(9,7-11)6-4-8/h8H,3-7H2,1-2H3
InChIKey
STAMXIXVXYCICG-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-7,7-dimethylbicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.05136 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.05864 153.5
[M+Na]+ 239.04058 153.4
[M+NH4]+ 234.08518 162.1
[M+K]+ 255.01452 152.1
[M-H]- 215.04408 153.0
[M+Na-2H]- 237.02603 154.5
[M]+ 216.05081 152.3
[M]- 216.05191 152.3
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.