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]+ 175.01169 122.2
[M+Na]+ 196.99363 132.4
[M-H]- 172.99713 128.7
[M+NH4]+ 192.03823 142.0
[M+K]+ 212.96757 125.0
[M+H-H2O]+ 157.00167 120.3
[M+HCOO]- 219.00261 142.3
[M+CH3COO]- 233.01826 181.3
[M+Na-2H]- 194.97908 131.5
[M]+ 174.00386 147.1
[M]- 174.00496 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.