CID 69907

1,1-diphenylacetone

Structural Information

Molecular Formula
C15H14O
SMILES
CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H14O/c1-12(16)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,1H3
InChIKey
DBNWBEGCONIRGQ-UHFFFAOYSA-N
Compound name
1,1-diphenylpropan-2-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

957
Patents

210.10446 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.11174 147.9
[M+Na]+ 233.09368 162.6
[M+NH4]+ 228.13828 157.4
[M+K]+ 249.06762 154.7
[M-H]- 209.09718 153.0
[M+Na-2H]- 231.07913 158.2
[M]+ 210.10391 151.6
[M]- 210.10501 151.6
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