CID 570091

1,2-diphenylprop-2-en-1-one

Structural Information

Molecular Formula
C15H12O
SMILES
C=C(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C15H12O/c1-12(13-8-4-2-5-9-13)15(16)14-10-6-3-7-11-14/h2-11H,1H2
InChIKey
ZTKPNSXSOUTJFJ-UHFFFAOYSA-N
Compound name
1,2-diphenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

138
Patents

208.08882 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.096096 145.7
[M+Na]+ 231.078038 151.9
[M-H]- 207.081544 152.1
[M+NH4]+ 226.122643 163.8
[M+K]+ 247.051978 148.0
[M+H-H2O]+ 191.086080 138.5
[M+HCOO]- 253.087021 168.4
[M+CH3COO]- 267.102671 187.2
[M+Na-2H]- 229.063486 150.9
[M]+ 208.08827142 143.9
[M]- 208.08936858 143.9
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