CID 5375876

4-formyl-trans-stilbene

Structural Information

Molecular Formula

C₁₅H₁₂O

SMILES

C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C=O

InChI

InChI=1S/C15H12O/c16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-12H/b7-6+

InChIKey

CLXSBHRRZNBTRT-VOTSOKGWSA-N

Compound name

4-[(E)-2-phenylethenyl]benzaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 328
Patents: 208.08882 Da
Monoisotopic Mass: 3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	209.09610	146.9
[M+Na]+	231.07804	162.9
[M+NH4]+	226.12264	156.5
[M+K]+	247.05198	153.3
[M-H]-	207.08154	152.2
[M+Na-2H]-	229.06349	157.7
[M]+	208.08827	150.9
[M]-	208.08937	150.9

Literature stripe

literature stripe

Patent stripe

patents stripe