CID 65007363

1-(bromomethyl)-1-(methoxymethyl)cyclobutane

Structural Information

Molecular Formula
C7H13BrO
SMILES
COCC1(CCC1)CBr
InChI
InChI=1S/C7H13BrO/c1-9-6-7(5-8)3-2-4-7/h2-6H2,1H3
InChIKey
NBUQPMAWDXHYRV-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-(methoxymethyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

192.01498 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.02226 134.9
[M+Na]+ 215.00420 133.1
[M+NH4]+ 210.04880 138.1
[M+K]+ 230.97814 133.1
[M-H]- 191.00770 132.7
[M+Na-2H]- 212.98965 136.5
[M]+ 192.01443 132.0
[M]- 192.01553 132.0
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

patents stripe