CID 129299643

(3-bromoprop-1-en-2-yl)cyclopropane

Structural Information

Molecular Formula
C6H9Br
SMILES
C=C(CBr)C1CC1
InChI
InChI=1S/C6H9Br/c1-5(4-7)6-2-3-6/h6H,1-4H2
InChIKey
DDCIRECTBKMOAL-UHFFFAOYSA-N
Compound name
3-bromoprop-1-en-2-ylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

159.98875 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.99603 128.0
[M+Na]+ 182.97797 140.7
[M-H]- 158.98147 135.3
[M+NH4]+ 178.02257 147.7
[M+K]+ 198.95191 130.0
[M+H-H2O]+ 142.98601 128.0
[M+HCOO]- 204.98695 149.1
[M+CH3COO]- 219.00260 180.2
[M+Na-2H]- 180.96342 135.5
[M]+ 159.98820 146.7
[M]- 159.98930 146.7
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

patents stripe