CID 884782

4-ethoxy-4'-methylbenzophenone

Structural Information

Molecular Formula
C16H16O2
SMILES
CCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C16H16O2/c1-3-18-15-10-8-14(9-11-15)16(17)13-6-4-12(2)5-7-13/h4-11H,3H2,1-2H3
InChIKey
URYAPIPAPKZONE-UHFFFAOYSA-N
Compound name
(4-ethoxyphenyl)-(4-methylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1
Patents

240.11504 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.122316 153.9
[M+Na]+ 263.104258 161.5
[M-H]- 239.107764 160.9
[M+NH4]+ 258.148863 171.5
[M+K]+ 279.078198 158.2
[M+H-H2O]+ 223.112300 146.5
[M+HCOO]- 285.113241 177.3
[M+CH3COO]- 299.128891 194.4
[M+Na-2H]- 261.089706 158.3
[M]+ 240.11449142 156.1
[M]- 240.11558858 156.1
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