CID 145874810

1-bromo-3-cyclopropylcyclobutane

Structural Information

Molecular Formula
C7H11Br
SMILES
C1CC1C2CC(C2)Br
InChI
InChI=1S/C7H11Br/c8-7-3-6(4-7)5-1-2-5/h5-7H,1-4H2
InChIKey
UVIJOKTUYWQBQF-UHFFFAOYSA-N
Compound name
1-bromo-3-cyclopropylcyclobutane
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 120.7
[M+Na]+ 196.993628 132.5
[M-H]- 172.997134 130.8
[M+NH4]+ 192.038233 134.6
[M+K]+ 212.967568 125.2
[M+H-H2O]+ 157.001670 116.7
[M+HCOO]- 219.002611 141.1
[M+CH3COO]- 233.018261 185.4
[M+Na-2H]- 194.979076 129.0
[M]+ 174.00386142 146.0
[M]- 174.00495858 146.0
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.