CID 12266549

(e)-4'-bromostilbene-4-carbaldehyde

Structural Information

Molecular Formula
C15H11BrO
SMILES
C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)Br)C=O
InChI
InChI=1S/C15H11BrO/c16-15-9-7-13(8-10-15)2-1-12-3-5-14(11-17)6-4-12/h1-11H/b2-1+
InChIKey
HLPFHEPKRGKOMT-OWOJBTEDSA-N
Compound name
4-[(E)-2-(4-bromophenyl)ethenyl]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

285.99933 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.00661 155.8
[M+Na]+ 308.98855 167.4
[M-H]- 284.99205 165.1
[M+NH4]+ 304.03315 175.3
[M+K]+ 324.96249 154.5
[M+H-H2O]+ 268.99659 155.2
[M+HCOO]- 330.99753 177.9
[M+CH3COO]- 345.01318 196.6
[M+Na-2H]- 306.97400 162.8
[M]+ 285.99878 174.6
[M]- 285.99988 174.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe