CID 61390869

2-(allyloxy)-3-bromobenzaldehyde

Structural Information

Molecular Formula
C10H9BrO2
SMILES
C=CCOC1=C(C=CC=C1Br)C=O
InChI
InChI=1S/C10H9BrO2/c1-2-6-13-10-8(7-12)4-3-5-9(10)11/h2-5,7H,1,6H2
InChIKey
NCXUZGJWKOHRDP-UHFFFAOYSA-N
Compound name
3-bromo-2-prop-2-enoxybenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.97859 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.98587 142.5
[M+Na]+ 262.96781 146.6
[M+NH4]+ 258.01241 147.1
[M+K]+ 278.94175 145.7
[M-H]- 238.97131 142.9
[M+Na-2H]- 260.95326 146.1
[M]+ 239.97804 142.0
[M]- 239.97914 142.0
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.