CID 2754200

2-hydroxy-2-phenyl-1-p-tolyl-ethanone

Structural Information

Molecular Formula
C15H14O2
SMILES
CC1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)O
InChI
InChI=1S/C15H14O2/c1-11-7-9-13(10-8-11)15(17)14(16)12-5-3-2-4-6-12/h2-10,14,16H,1H3
InChIKey
ZXFSXZYDGCZLBE-UHFFFAOYSA-N
Compound name
2-hydroxy-1-(4-methylphenyl)-2-phenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

47
Patents

226.09938 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10666 150.3
[M+Na]+ 249.08860 156.6
[M-H]- 225.09210 155.7
[M+NH4]+ 244.13320 167.3
[M+K]+ 265.06254 153.1
[M+H-H2O]+ 209.09664 143.3
[M+HCOO]- 271.09758 171.5
[M+CH3COO]- 285.11323 188.6
[M+Na-2H]- 247.07405 154.2
[M]+ 226.09883 149.2
[M]- 226.09993 149.2
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