CID 137945418

1-(bromomethyl)-1-ethenylcyclobutane

Structural Information

Molecular Formula
C7H11Br
SMILES
C=CC1(CCC1)CBr
InChI
InChI=1S/C7H11Br/c1-2-7(6-8)4-3-5-7/h2H,1,3-6H2
InChIKey
ZTHVWGQSGSVBJG-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-ethenylcyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.00441 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.011686 122.2
[M+Na]+ 196.993628 132.4
[M-H]- 172.997134 128.7
[M+NH4]+ 192.038233 142.0
[M+K]+ 212.967568 125.0
[M+H-H2O]+ 157.001670 120.3
[M+HCOO]- 219.002611 142.3
[M+CH3COO]- 233.018261 181.3
[M+Na-2H]- 194.979076 131.5
[M]+ 174.00386142 147.1
[M]- 174.00495858 147.1
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.