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]+ 175.011686 131.3
[M+Na]+ 196.993628 144.5
[M-H]- 172.997134 138.8
[M+NH4]+ 192.038233 152.4
[M+K]+ 212.967568 134.1
[M+H-H2O]+ 157.001670 132.4
[M+HCOO]- 219.002611 152.7
[M+CH3COO]- 233.018261 181.8
[M+Na-2H]- 194.979076 140.5
[M]+ 174.00386142 151.4
[M]- 174.00495858 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.