CID 130700405

1-(bromomethyl)-1-(prop-2-en-1-yl)cyclopropane

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.00441 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.01169 131.3
[M+Na]+ 196.99363 144.5
[M-H]- 172.99713 138.8
[M+NH4]+ 192.03823 152.4
[M+K]+ 212.96757 134.1
[M+H-H2O]+ 157.00167 132.4
[M+HCOO]- 219.00261 152.7
[M+CH3COO]- 233.01826 181.8
[M+Na-2H]- 194.97908 140.5
[M]+ 174.00386 151.4
[M]- 174.00496 151.4
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.